4H-1,2,4-Triazol-4-amine,3,5-dimethyl
Modify Date: 2026-08-08 07:55:07
4H-1,2,4-Triazol-4-amine,3,5-dimethyl structure
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Common Name | 4H-1,2,4-Triazol-4-amine,3,5-dimethyl | ||
|---|---|---|---|---|
| CAS Number | 3530-15-2 | Molecular Weight | 112.13300 | |
| Density | 1.34g/cm3 | Boiling Point | 300.7ºC at 760mmHg | |
| Molecular Formula | C4H8N4 | Melting Point | 196-199°C | |
| MSDS | N/A | Flash Point | 135.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3,5-dimethyl-1,2,4-triazol-4-amine |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.34g/cm3 |
|---|---|
| Boiling Point | 300.7ºC at 760mmHg |
| Melting Point | 196-199°C |
| Molecular Formula | C4H8N4 |
| Molecular Weight | 112.13300 |
| Flash Point | 135.7ºC |
| Exact Mass | 112.07500 |
| PSA | 56.73000 |
| LogP | 0.18990 |
| Index of Refraction | 1.64 |
| InChIKey | MIIKMZAVLKMOFM-UHFFFAOYSA-N |
| SMILES | Cc1nnc(C)n1N |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
Risk Phrases: 36/37/38 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin. Potential Health Effects Eye: Causes eye irritation. Skin: Causes skin irritation. May be harmful if absorbed through the skin. Ingestion: May cause irritation of the digestive tract. May be harmful if swallowed. Inhalation: Causes respiratory tract irritation. May be harmful if inhaled. Chronic: Not available. Section 4 - FIRST AID MEASURES Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid. Skin: Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Get medical aid. Wash mouth out with water. Inhalation: Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid. Notes to Physician: Treat symptomatically and supportively. Section 5 - FIRE FIGHTING MEASURES General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. Extinguishing Media: Use water spray, dry chemical, carbon dioxide, or chemical foam. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Vacuum or sweep up material and place into a suitable disposal container. Section 7 - HANDLING and STORAGE Handling: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Storage: Store in a cool, dry place. Store in a tightly closed container. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 3530-15-2: Personal Protective Equipment Eyes: Not available. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Solid Color: white Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 196 - 198 deg C Autoignition Temperature: Not available. Flash Point: Not available. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C4H8N4 Molecular Weight: 112 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Strong oxidizing agents, acid chlorides. Hazardous Decomposition Products: Nitrogen oxides, carbon monoxide, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 3530-15-2 unlisted. LD50/LC50: Not available. Carcinogenicity: 3,5-Dimethyl-4H-1,2,4-triazol-4-amine - Not listed by ACGIH, IARC, or NTP. Section 12 - ECOLOGICAL INFORMATION Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA No information available. IMO No information available. RID/ADR No information available. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XI Risk Phrases: R 36/37/38 Irritating to eyes, respiratory system and skin. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 Wear suitable gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 3530-15-2: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 3530-15-2 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 3530-15-2 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Risk Phrases | 36/37/38 |
|---|---|
| Safety Phrases | S26-S36/37/39 |
| HS Code | 2933990090 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 1 | |
CAS#:75-05-8
CAS#:1068-57-1
CAS#:64-19-7
CAS#:2168-84-5
CAS#:705-19-1
CAS#:1563-87-7
CAS#:141-78-6
CAS#:443-48-1
CAS#:683-58-9
CAS#:6205-72-7![2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid structure](https://image.chemsrc.com/caspic/446/108801-39-4.png)
CAS#:108801-39-4This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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|
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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|
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: qHTS of TDP-43 Inhibitors: NCGC Sytravon Library Screen
Source: NCGC
External Id: tdp43-p2-repeat
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3,5-dimethyl-4-amino-4H-1,2,4-triazole |
| 3,5-dimethanyl-4-amino-1,2,4-triazole |
| 3,5-dimethyl-4-amino-1,2,4-triazole |
| 4-amino-3,5-dimethyl-4H-1,2,4-triazole |
| 3,5-dimethyl-1,2,4-triazole-4-ylamine |
| MFCD00051647 |
| 4-amino-3,5-dimethyl-{1,2,4}triazole |
| 3,5-Dimethyl-4H-1,2,4-triazol-4-amine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: InChIKey of 3,5-dimethyl-1,2,4-triazol-4-amine is MIIKMZAVLKMOFM-UHFFFAOYSA-N. |
| Q: What is the English name of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: The English name of 3,5-dimethyl-1,2,4-triazol-4-amine is 3,5-dimethyl-1,2,4-triazol-4-amine. |
| Q: What are the upstream materials of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: Related upstream materials(CAS) of 3,5-dimethyl-1,2,4-triazol-4-amine: 75-05-8;1068-57-1;64-19-7;2168-84-5;705-19-1;1563-87-7;141-78-6;443-48-1;683-58-9;6205-72-7. |
| Q: What are the downstream products of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: Related downstream products(CAS) of 3,5-dimethyl-1,2,4-triazol-4-amine: 108801-39-4. |
| Q: What is the melting point of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: Melting point of 3,5-dimethyl-1,2,4-triazol-4-amine is 196-199°C. |
| Q: What is the CAS number of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: CAS number of 3,5-dimethyl-1,2,4-triazol-4-amine is 3530-15-2. |
| Q: What is the LogP of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: LogP of 3,5-dimethyl-1,2,4-triazol-4-amine is 0.18990. |
| Q: What is the safety information for 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: Safety information for 3,5-dimethyl-1,2,4-triazol-4-amine: S26-S36/37/39. |
| Q: What is the SMILES notation of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: SMILES notation of 3,5-dimethyl-1,2,4-triazol-4-amine is Cc1nnc(C)n1N. |
| Q: What is the molecular weight of 3,5-dimethyl-1,2,4-triazol-4-amine? |
| A: Molecular weight of 3,5-dimethyl-1,2,4-triazol-4-amine is 112.13300. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |