o-Xylylamine
o-Xylylamine structure
|
Common Name | o-Xylylamine | ||
|---|---|---|---|---|
| CAS Number | 89-93-0 | Molecular Weight | 121.180 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 203.6±9.0 °C at 760 mmHg | |
| Molecular Formula | C8H11N | Melting Point | <0ºC | |
| MSDS | Chinese USA | Flash Point | 83.9±0.0 °C | |
| Symbol |
GHS05 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Methylbenzylamine |
|---|---|
| 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 | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 203.6±9.0 °C at 760 mmHg |
| Melting Point | <0ºC |
| Molecular Formula | C8H11N |
| Molecular Weight | 121.180 |
| Flash Point | 83.9±0.0 °C |
| Exact Mass | 121.089149 |
| PSA | 26.02000 |
| LogP | 1.55 |
| Vapour Pressure | 0.3±0.4 mmHg at 25°C |
| Index of Refraction | 1.542 |
| InChIKey | CJAAPVQEZPAQNI-UHFFFAOYSA-N |
| SMILES | Cc1ccccc1CN |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS05 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H314 |
| Precautionary Statements | P280-P305 + P351 + P338-P310 |
| Personal Protective Equipment | Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | C:Corrosive; |
| Risk Phrases | R34 |
| Safety Phrases | S26-S27-S36/37/39-S45 |
| RIDADR | UN 2735 8/PG 2 |
| WGK Germany | 3 |
| RTECS | DP5800000 |
| Packaging Group | III |
| Hazard Class | 8 |
| HS Code | 2921499090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 10 | |
CAS#:529-19-1
CAS#:529-20-4
CAS#:527-85-5
CAS#:15267-95-5
CAS#:100-46-9
CAS#:14683-79-5
CAS#:91-15-6
CAS#:126799-83-5
CAS#:64-17-5
CAS#:89-95-2
CAS#:23707-33-7
CAS#:138350-92-2![tert-butyl N-[(2-methylphenyl)methyl]carbamate structure](https://image.chemsrc.com/caspic/492/138350-83-1.png)
CAS#:138350-83-1
CAS#:17064-20-9
CAS#:15903-58-9![2-(O-TOLYL)-1H-BENZO[D]IMIDAZOLE structure](https://image.chemsrc.com/caspic/356/2963-64-6.png)
CAS#:2963-64-6![2,3,4,6,11,11a-hexahydro-1H-benzo[b]quinolizine structure](https://image.chemsrc.com/caspic/038/7234-65-3.png)
CAS#:7234-65-3
CAS#:7661-42-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2921499090 |
|---|---|
| Summary | 2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Heteroatom-directed lateral lithiation: synthesis of isoquinoline derivatives from N-(tert-butoxycarbonyl)-2-methylbenzylamines. Clark RD, et al.
Can. J. Chem. 72(1) , 23-30, (1994)
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This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Inhibition of the Burkholderia mallei acyl-homoserine lactone synthase BmaI1
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: autoinducer synthetase family protein [Burkholderia mallei ATCC 23344]
External Id: HMS1126
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: Inhibition of phenylethanolamine N-methyltransferase(PNMT)activity
Source: ChEMBL
Target: Phenylethanolamine N-methyltransferase
External Id: CHEMBL821668
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-Methylbenzylamine |
| (2-methylphenyl)methanamine |
| o-Xylylamine |
| o-Methylbenzylamine |
| 2-Methylbenzenemethanamine |
| Z1R B1 |
| MFCD00008112 |
| EINECS 201-952-1 |
| 1-(2-Methylphenyl)methanamine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2-Methylbenzylamine? |
| A: InChIKey of 2-Methylbenzylamine is CJAAPVQEZPAQNI-UHFFFAOYSA-N. |
| Q: What is the melting point of 2-Methylbenzylamine? |
| A: Melting point of 2-Methylbenzylamine is <0ºC. |
| Q: What is the molecular formula of 2-Methylbenzylamine? |
| A: Molecular formula of 2-Methylbenzylamine is C8H11N. |
| Q: What are the downstream products of 2-Methylbenzylamine? |
| A: Related downstream products(CAS) of 2-Methylbenzylamine: 89-95-2;23707-33-7;529-19-1;138350-92-2;138350-83-1;17064-20-9;15903-58-9;2963-64-6;7234-65-3;7661-42-9. |
| Q: What is the boiling point of 2-Methylbenzylamine? |
| A: Boiling point of 2-Methylbenzylamine is 203.6±9.0 °C at 760 mmHg. |
| Q: What are the upstream materials of 2-Methylbenzylamine? |
| A: Related upstream materials(CAS) of 2-Methylbenzylamine: 529-19-1;529-20-4;527-85-5;15267-95-5;100-46-9;14683-79-5;91-15-6;126799-83-5;64-17-5. |
| Q: What is the CAS number of 2-Methylbenzylamine? |
| A: CAS number of 2-Methylbenzylamine is 89-93-0. |
| Q: What is the LogP of 2-Methylbenzylamine? |
| A: LogP of 2-Methylbenzylamine is 1.55. |
| Q: What is the SMILES notation of 2-Methylbenzylamine? |
| A: SMILES notation of 2-Methylbenzylamine is Cc1ccccc1CN. |
| Q: What is the English name of 2-Methylbenzylamine? |
| A: The English name of 2-Methylbenzylamine is 2-Methylbenzylamine. |
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. |