CAS Number99-94-5
Synonyms2PNS-Q06-0; Crithminic acid; para-Toluic acid; p-Toluic acid; 4-Methyl-Benzoic Acid; 4'-methyl-2-biphenylsulphonyl chloride; Toluenecarboxylic acid; p-toluenebenzenesulfonyl chloride; p-Me-benzoic acid; EINECS 202-803-3; p-methyl benzoic acid; p-toluenecarboxylic acid; p-Methylbenzoic Acid; 4'-Methylbiphenyl-2-sulfonyl chloride; MFCD00002565; 4-TOLUIC ACID; 4-Methyl Benzoic acid; 4-Methylbenzoic acid; p-toluylic acid
Molecular FormulaCH3C6H4CO2H
Molecular Weight136.15
Purity98%
Density1.2±0.1 g/cm3
Boiling Point274-275 °C (lit.)
Melting Point177-180 °C (lit.)
AppearanceColorless crystal or white crystalline powder
EINECS202-803-3
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 99-94-5 |
| Catalog No. | 2A-9018164 |
| Chinese Name | 对甲基苯甲酸 |
| Synonyms | 2PNS-Q06-0; Crithminic acid; para-Toluic acid; p-Toluic acid; 4-Methyl-Benzoic Acid; 4'-methyl-2-biphenylsulphonyl chloride; Toluenecarboxylic acid; p-toluenebenzenesulfonyl chloride; p-Me-benzoic acid; EINECS 202-803-3; p-methyl benzoic acid; p-toluenecarboxylic acid; p-Methylbenzoic Acid; 4'-Methylbiphenyl-2-sulfonyl chloride; MFCD00002565; 4-TOLUIC ACID; 4-Methyl Benzoic acid; 4-Methylbenzoic acid; p-toluylic acid |
| Molecular Formula | CH3C6H4CO2H |
| Molecular Weight | 136.15 |
| Purity | 98 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 274-275 °C (lit.) |
| Melting Point | 177-180 °C (lit.) |
| Appearance | Colorless crystal or white crystalline powder |
| Water Solubility | <0.1 g/100 mL at 19 ºC |
| Storage Condition | Store in a cool, ventilated warehouse. Keep away f |
| Application | p-Toluic acid (4-Methylbenzoic acid) is a substituted benzoic acid and an intermediate in the synthesis of p-aminomethylbenzoic acid (PAMBA), p-toluonitrile, etc. |
| EINECS | 202-803-3 |
| HTC | 29163900 |
| PubChem ID | 24900160 |
| MDL Number | MFCD00002565 |
| SMILES | Cc1ccc(cc1)C(O)=O |
| InChI | 1S/C8H8O2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H,9,10) |
| InChI Key | LPNBBFKOUUSUDB-UHFFFAOYSA-N |
| Beilstein/REAXYS | 507600 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/18164_1_99_94_5.pdf |
| Bioactivity | p-Toluic acid (4-Methylbenzoic acid) is a substituted benzoic acid and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. Related Catalog Research Areas >> Others Target Human Endogenous Metabolite Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 275.3±9.0 °C at 760 mmHg Melting Point 179 °C Molecular Formula C8H8O2 Molecular Weight 136.148 Flash Point 124.7±13.4 °C Exact Mass 136.052429 PSA 37.30000 LogP 2.36 Vapour Pressure 0.0±0.6 mmHg at 25°C Index of Refraction 1.556 InChIKey LPNBBFKOUUSUDB-UHFFFAOYSA-N SMILES Cc1ccc(C(=O)O)cc1 Storage condition Store at RT. Stability Stable. Incompatible with strong oxidizing agents, strong bases. Water Solubility <0.1 g/100 mL at 19 ºC |
| Use of | p-Toluic acid (4-Methylbenzoic acid) is a substituted benzoic acid and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. Properties Name p-toluic acid Synonym More Synonyms 4-Methylbenzoic acid Biological Activity Description p-Toluic acid (4-Methylbenzoic acid) is a substituted benzoic acid and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. Related Catalog Research Areas >> Others Human Endogenous Metabolite Chemical & Physical Properties Molecular Formula C8H8O2 Exact Mass 136.052429 PSA 37.30000 Index of Refraction 1.556 InChIKey LPNBBFKOUUSUDB-UHFFFAOYSA-N Storage condition Store at RT. Stability Stable. Incompatible with strong oxidizing agents, strong bases. |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Chemical name |
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