5-Methoxy-2-methylbenzoic acid supplier

Name
5-METHOXY-2-METHYL-BENZOIC ACID
EINECS
CAS No. 3168-59-0
Article Data10
CAS DataBase
Density 1.168 g/cm³
Solubility
Melting Point 146-147℃
Formula C₉H₁₀O₃
Boiling Point 306 °C at 760 mmHg
Molecular Weight 166.177
Flash Point 124.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Methyl-m-anisic acid;NSC 97602;m-Anisicacid, 6-methyl- (6CI,7CI,8CI);
PSA 46.53000
LogP 1.70180

5-Methoxy-2-methylbenzoic acid Specification

The CAS register number of 5-Methoxy-2-methylbenzoic acid is 3168-59-0. It also can be called as Benzoic acid, 5-methoxy-2-methyl- and the systematic name about this chemical is 5-methoxy-2-methylbenzoic acid. The molecular formula about this chemical is C₉H₁₀O₃and the molecular weight is 166.1739.

Physical properties about 5-Methoxy-2-methylbenzoic acid are: (1)ACD/LogP: 2.48; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 10.29; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 35.53Å²; (10)Index of Refraction: 1.54; (11)Molar Refractivity: 44.68 cm³; (12)Molar Volume: 142.2 cm³; (13)Polarizability: 17.71x10^-24cm³; (14)Surface Tension: 42.7 dyne/cm; (15)Flash Point: 124.3 °C; (16)Enthalpy of Vaporization: 57.7 kJ/mol; (17)Boiling Point: 306 °C at 760 mmHg; (18)Vapour Pressure: 0.000347 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(OC)ccc1C
(2)InChI: InChI=1/C9H10O3/c1-6-3-4-7(12-2)5-8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
(3)InChIKey: OJDIEULKBFEZGD-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C9H10O3/c1-6-3-4-7(12-2)5-8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
(5)Std. InChIKey: OJDIEULKBFEZGD-UHFFFAOYSA-N

Product Name

5-METHOXY-2-METHYL-BENZOIC ACID

5-Methoxy-2-methylbenzoic acid Specification

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