Benzoic acid,4-methyl-3-(phenylmethoxy)- supplier

Name
3-Benzyloxy-4-Methylbenzoic Acid
EINECS
CAS No. 165662-68-0
Density 1.193 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₂O₃
Boiling Point 422.1 °C at 760 mmHg
Molecular Weight 242.274
Flash Point 160 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(Benzyloxy)-4-methylbenzoic acid;4-Methyl-3-(phenylmethoxy)benzoic acid;
PSA 46.53000
LogP 3.27220

Benzoic acid,4-methyl-3-(phenylmethoxy)- Specification

The Benzoic acid,4-methyl-3-(phenylmethoxy)-, with the CAS registry number 165662-68-0, is also known as 4-Methyl-3-(phenylmethoxy)benzoic acid. This chemical's molecular formula is C₁₄H₁₂O₃ and molecular weight is 242.27. What's more, its systematic name is 3-(Benzyloxy)-4-methylbenzoic acid.

Physical properties of Benzoic acid,4-methyl-3-(phenylmethoxy)- are: (1)ACD/LogP: 4.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.84; (4)ACD/LogD (pH 7.4): 1.27; (5)ACD/BCF (pH 5.5): 41.54; (6)ACD/BCF (pH 7.4): 1.12; (7)ACD/KOC (pH 5.5): 214.86; (8)ACD/KOC (pH 7.4): 5.8; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 46.53 Å²; (13)Index of Refraction: 1.597; (14)Molar Refractivity: 69.17 cm³; (15)Molar Volume: 202.9 cm³; (16)Polarizability: 27.42×10^-24cm³; (17)Surface Tension: 48.6 dyne/cm; (18)Density: 1.193 g/cm³; (19)Flash Point: 160 °C; (20)Enthalpy of Vaporization: 71.29 kJ/mol; (21)Boiling Point: 422.1 °C at 760 mmHg; (22)Vapour Pressure: 7.02E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c2cc(OCc1ccccc1)c(C)cc2
(2)InChI: InChI=1/C15H14O3/c1-11-7-8-13(15(16)17)9-14(11)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)
(3)InChIKey: ABDMYEWDLHJGIL-UHFFFAOYSA-N

Product Name

3-Benzyloxy-4-Methylbenzoic Acid

Benzoic acid,4-methyl-3-(phenylmethoxy)- Specification

Related Products

Hot Products