Methyl 4-benzyloxy-3-methoxybenzoate supplier

Name
METHYL 4-BENZYLOXY-3-METHOXYBENZOATE
EINECS
CAS No. 56441-97-5
Article Data41
CAS DataBase
Density 1.154 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₆O₄
Boiling Point 400.12 °C at 760 mmHg
Molecular Weight 272.301
Flash Point 176.641 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Benzyloxy-3-methoxybenzoic acid methyl ester;Methyl 4-(benzyloxy)-3-methoxybenzoate;Methyl 3-methoxy-4-(benzyloxy)benzoate;
PSA 44.76000
LogP 3.06080

Methyl 4-benzyloxy-3-methoxybenzoate Specification

The Methyl 4-benzyloxy-3-methoxybenzoate, with the CAS registry number 56441-97-5, is also known as 4-Benzyloxy-3-methoxybenzoic acid methyl ester. It belongs to the product category of Aromatic Esters. This chemical's molecular formula is C₁₆H₁₆O₄ and molecular weight is 272.30. What's more, its systematic name is Methyl 4-(benzyloxy)-3-methoxybenzoate.

Physical properties of Methyl 4-benzyloxy-3-methoxybenzoate are: (1)ACD/LogP: 3.762; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.76; (4)ACD/LogD (pH 7.4): 3.76; (5)ACD/BCF (pH 5.5): 425.66; (6)ACD/BCF (pH 7.4): 425.66; (7)ACD/KOC (pH 5.5): 2651.49; (8)ACD/KOC (pH 7.4): 2651.49; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 44.76 Å²; (13)Index of Refraction: 1.556; (14)Molar Refractivity: 75.871 cm³; (15)Molar Volume: 236.033 cm³; (16)Polarizability: 30.077×10^-24cm³; (17)Surface Tension: 41.1 dyne/cm; (18)Density: 1.154 g/cm³; (19)Flash Point: 176.641 °C; (20)Enthalpy of Vaporization: 65.094 kJ/mol; (21)Boiling Point: 400.12 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)c2cc(OC)c(OCc1ccccc1)cc2
(2)Std. InChI: InChI=1S/C16H16O4/c1-18-15-10-13(16(17)19-2)8-9-14(15)20-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
(3)Std. InChIKey: FPGZHXRPIFVQOL-UHFFFAOYSA-N

Product Name

METHYL 4-BENZYLOXY-3-METHOXYBENZOATE

Methyl 4-benzyloxy-3-methoxybenzoate Specification

Related Products

Hot Products