DIMETHYLBENZOIC ACID
DIMETHYLBENZOIC ACID structure
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Common Name | DIMETHYLBENZOIC ACID | ||
|---|---|---|---|---|
| CAS Number | 603-79-2 | Molecular Weight | 150.174 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 281.5±9.0 °C at 760 mmHg | |
| Molecular Formula | C9H10O2 | Melting Point | 144-146 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 129.6±13.4 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,3-dimethylbenzoic acid |
|---|---|
| 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 | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 281.5±9.0 °C at 760 mmHg |
| Melting Point | 144-146 °C(lit.) |
| Molecular Formula | C9H10O2 |
| Molecular Weight | 150.174 |
| Flash Point | 129.6±13.4 °C |
| Exact Mass | 150.068085 |
| PSA | 37.30000 |
| LogP | 2.82 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.550 |
| InChIKey | RIZUCYSQUWMQLX-UHFFFAOYSA-N |
| SMILES | Cc1cccc(C(=O)O)c1C |
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 | 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-S36/37/39-S22 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | DG8734000 |
| HS Code | 2916399090 |
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 | |
|---|---|
| DownStream 10 | |
CAS#:95-47-6
CAS#:124-38-9
CAS#:5724-56-1
CAS#:576-23-8
CAS#:526-73-8
CAS#:64-18-6
CAS#:13651-14-4
CAS#:5580-34-7
CAS#:56812-61-4
CAS#:87-59-2
CAS#:223553-34-2
CAS#:21900-46-9
CAS#:81093-21-2
CAS#:86347-14-0
CAS#:933-98-2
CAS#:569-51-7
CAS#:5779-93-1
CAS#:127168-91-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives 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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Specific involvement of two amino acid residues in cis-nerolidol binding to odorant-binding protein 5 AlinOBP5 in the alfalfa plant bug, Adelphocoris lineolatus (Goeze).
Insect Mol. Biol. 22(2) , 172-82, (2013) Olfaction plays an important role in insects' survival and reproduction. Odorant-binding proteins (OBPs) are considered to be one of the crucial proteins in the insect olfactory pathway. In this study... |
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Metabolic fate of 3,4,5- and 2,3,5-trimethylphenyl methylcarbamates, the major constituents in Landrin insecticide.
J. Agric. Food Chem. 18(3) , 467-74, (1970)
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Inducibility of the TOL catabolic pathway in Pseudomonas putida (pWW0) growing on succinate in continuous culture: evidence of carbon catabolite repression control.
J. Bacteriol. 176(8) , 2354-61, (1994) The TOL catabolic genes in Pseudomonas putida (pWW0) are clustered in the upper operon, encoding enzymes for the conversion of toluene and xylenes to benzoate and toluates, and the meta-cleavage opero... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2,3-dimethyl benzoic acid |
| EINECS 210-058-0 |
| hemelliticacid |
| 2,3-dimethyl-benzoicaci |
| DIMETHYLBENZOIC ACID |
| RARECHEM AL BO 0357 |
| 2,3-Dimethylbenzoic acid |
| O-XYLENE-3-CARBOXYLIC ACID |
| 2,3-Dimethyl-benzoesaeure |
| 2,3-dimethylbenzene carboxylic acid |
| vic.-o-xylylic acid |
| MFCD00002479 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 2,3-dimethylbenzoic acid? |
| A: SMILES notation of 2,3-dimethylbenzoic acid is Cc1cccc(C(=O)O)c1C. |
| Q: What is the safety information for 2,3-dimethylbenzoic acid? |
| A: Safety information for 2,3-dimethylbenzoic acid: S26-S36-S36/37/39-S22. |
| Q: What is the InChIKey of 2,3-dimethylbenzoic acid? |
| A: InChIKey of 2,3-dimethylbenzoic acid is RIZUCYSQUWMQLX-UHFFFAOYSA-N. |
| Q: What are the downstream products of 2,3-dimethylbenzoic acid? |
| A: Related downstream products(CAS) of 2,3-dimethylbenzoic acid: 5580-34-7;5724-56-1;223553-34-2;21900-46-9;81093-21-2;86347-14-0;933-98-2;569-51-7;5779-93-1;127168-91-6. |
| Q: What is the boiling point of 2,3-dimethylbenzoic acid? |
| A: Boiling point of 2,3-dimethylbenzoic acid is 281.5±9.0 °C at 760 mmHg. |
| Q: What is the polar surface area (PSA) of 2,3-dimethylbenzoic acid? |
| A: Polar surface area (PSA) of 2,3-dimethylbenzoic acid is 37.30000. |
| Q: What is the melting point of 2,3-dimethylbenzoic acid? |
| A: Melting point of 2,3-dimethylbenzoic acid is 144-146 °C(lit.). |
| Q: What is the molecular weight of 2,3-dimethylbenzoic acid? |
| A: Molecular weight of 2,3-dimethylbenzoic acid is 150.174. |
| Q: What is the CAS number of 2,3-dimethylbenzoic acid? |
| A: CAS number of 2,3-dimethylbenzoic acid is 603-79-2. |
| Q: What are the upstream materials of 2,3-dimethylbenzoic acid? |
| A: Related upstream materials(CAS) of 2,3-dimethylbenzoic acid: 95-47-6;124-38-9;5724-56-1;576-23-8;526-73-8;64-18-6;13651-14-4;5580-34-7;56812-61-4;87-59-2. |
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. |