5-Methylsalicylic acid
5-Methylsalicylic acid structure
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Common Name | 5-Methylsalicylic acid | ||
|---|---|---|---|---|
| CAS Number | 89-56-5 | Molecular Weight | 152.15 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 299.8±28.0 °C at 760 mmHg | |
| Molecular Formula | C8H8O3 | Melting Point | 163-165 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 149.3±20.5 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of 5-Methylsalicylic acid2-Hydroxy-5-methylbenzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-Methylsalicylic acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | 2-Hydroxy-5-methylbenzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
|---|---|
| Related Catalog |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 299.8±28.0 °C at 760 mmHg |
| Melting Point | 163-165 °C(lit.) |
| Molecular Formula | C8H8O3 |
| Molecular Weight | 152.15 |
| Flash Point | 149.3±20.5 °C |
| Exact Mass | 152.047348 |
| PSA | 57.53000 |
| LogP | 2.52 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.600 |
| InChIKey | DLGBEGBHXSAQOC-UHFFFAOYSA-N |
| SMILES | Cc1ccc(O)c(C(=O)O)c1 |
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 |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/39-S22-S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | GP3920200 |
| HS Code | 2942000000 |
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 10 | |
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| DownStream 10 | |
CAS#:99-04-7
CAS#:56-23-5
CAS#:106-44-5
CAS#:6342-60-5
CAS#:6967-82-4![N-[2-acetoxy-5-methylbenzoyl]-S-methyl-S-phenylsulfoximine Structure](https://image.chemsrc.com/caspic/266/1377585-09-5.png)
CAS#:1377585-09-5
CAS#:124-38-9
CAS#:1121-70-6
CAS#:1450-72-2
CAS#:298-14-6
CAS#:103261-02-5
CAS#:42753-75-3
CAS#:34265-58-2
CAS#:39506-61-1
CAS#:14504-08-6
CAS#:25045-35-6
CAS#:22802-67-1
CAS#:25045-36-7
CAS#:67191-44-0
CAS#:616-76-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918290000 |
|---|---|
| Summary | HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% 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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Identifying chelators for metalloprotein inhibitors using a fragment-based approach.
J. Med. Chem. 54 , 591-602, (2011) Fragment-based lead design (FBLD) has been used to identify new metal-binding groups for metalloenzyme inhibitors. When screened at 1 mM, a chelator fragment library (CFL-1.1) of 96 compounds produced... |
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Radiation metabolomics. 1. Identification of minimally invasive urine biomarkers for gamma-radiation exposure in mice.
Radiat. Res. 170(1) , 1-14, (2008) Gamma-radiation exposure has both short- and long-term adverse health effects. The threat of modern terrorism places human populations at risk for radiological exposures, yet current medical counterme... |
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Specificity data of the salicylate assay by fluorescent polarization immunoassay.
J. Anal. Toxicol. 13(6) , 358-60, (1989) We studied the recently developed Abbott Laboratories fluorescent polarization immunoassay (FPIA) for salicylates in serum. The cross-reactivity test of the assay was performed with 20 substances that... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Inhibition of mushroom tyrosinase at 1 mM after 10 mins
Source: ChEMBL
Target: Polyphenol oxidase 2
External Id: CHEMBL1664428
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Name: Inhibition of human recombinant 5-lipoxygenase at 1 mM after 10 mins by fluorescence ...
Source: ChEMBL
Target: Polyunsaturated fatty acid 5-lipoxygenase
External Id: CHEMBL1664429
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Name: Inhibition of recombinant anthrax lethal factor at 1 mM after 30 mins by fluorescence...
Source: ChEMBL
Target: Lethal factor
External Id: CHEMBL1664430
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Name: Inhibition of human recombinant MMP1 at 1 mM after 30 mins
Source: ChEMBL
Target: Interstitial collagenase
External Id: CHEMBL1664431
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Name: Inhibition of human recombinant MMP2 at 1 mM after 30 mins
Source: ChEMBL
Target: 72 kDa type IV collagenase
External Id: CHEMBL1664432
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Name: Chaperone activity at recombinant human C-terminal FLAG-tagged pendrin P123S mutant e...
Source: ChEMBL
Target: Pendrin
External Id: CHEMBL4017616
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Name: Binding affinity to CK2alpha (unknown origin) by ITC
Source: ChEMBL
Target: Casein kinase II subunit alpha
External Id: CHEMBL4035520
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Name: Binding affinity to CK2alpha (unknown origin) assessed as change in melting temperatu...
Source: ChEMBL
Target: Casein kinase II subunit alpha
External Id: CHEMBL4035521
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Name: Cytotoxicity against HEK293 cells harboring pendrin P123S mutant after 72 hrs by MTT ...
Source: ChEMBL
Target: HEK293
External Id: CHEMBL4017610
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Name: Chaperone activity at recombinant human C-terminal FLAG-tagged pendrin P123S mutant e...
Source: ChEMBL
Target: Pendrin
External Id: CHEMBL4017624
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-Hydroxy-5-methylbenzoic acid |
| MFCD00002461 |
| 5-Methyl Salicylic Acid |
| 5-methylsalicylic acid |
| EINECS 201-918-6 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 5-Methylsalicylic acid? |
| A: Safety information for 5-Methylsalicylic acid: S26-S36/39-S22-S36. |
| Q: What is the molecular formula of 5-Methylsalicylic acid? |
| A: Molecular formula of 5-Methylsalicylic acid is C8H8O3. |
| Q: What are the upstream materials of 5-Methylsalicylic acid? |
| A: Related upstream materials(CAS) of 5-Methylsalicylic acid: 99-04-7;56-23-5;106-44-5;6342-60-5;6967-82-4;1377585-09-5;124-38-9;1121-70-6;1450-72-2;298-14-6. |
| Q: What is the InChIKey of 5-Methylsalicylic acid? |
| A: InChIKey of 5-Methylsalicylic acid is DLGBEGBHXSAQOC-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 5-Methylsalicylic acid? |
| A: Polar surface area (PSA) of 5-Methylsalicylic acid is 57.53000. |
| Q: What are the downstream products of 5-Methylsalicylic acid? |
| A: Related downstream products(CAS) of 5-Methylsalicylic acid: 103261-02-5;42753-75-3;34265-58-2;39506-61-1;14504-08-6;25045-35-6;22802-67-1;25045-36-7;67191-44-0;616-76-2. |
| Q: What is the SMILES notation of 5-Methylsalicylic acid? |
| A: SMILES notation of 5-Methylsalicylic acid is Cc1ccc(O)c(C(=O)O)c1. |
| Q: What is the CAS number of 5-Methylsalicylic acid? |
| A: CAS number of 5-Methylsalicylic acid is 89-56-5. |
| Q: What are the uses of 5-Methylsalicylic acid? |
| A: Main uses of 5-Methylsalicylic acid: 2-Hydroxy-5-methylbenzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
| Q: What is the melting point of 5-Methylsalicylic acid? |
| A: Melting point of 5-Methylsalicylic acid is 163-165 °C(lit.). |
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. |