[1,1'-Biphenyl]-4-carboxylicacid, 3'-methoxy- supplier

Name
3'-METHOXY-BIPHENYL-4-CARBOXYLIC ACID
EINECS
CAS No. 5783-36-8
Article Data10
CAS DataBase
Density 1.193 g/cm³
Solubility
Melting Point 197-198℃
Formula C₁₄H₁₂O₃
Boiling Point 399.4 °C at 760 mmHg
Molecular Weight 228.247
Flash Point 153.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Biphenylcarboxylicacid, 3'-methoxy- (7CI,8CI);3'-Methoxy-4-biphenylcarboxylic acid;
PSA 46.53000
LogP 3.06040

[1,1'-Biphenyl]-4-carboxylicacid, 3'-methoxy- Specification

The CAS register number of [1,1'-Biphenyl]-4-carboxylicacid, 3'-methoxy- is 5783-36-8. It also can be called as 4-Biphenyl-(3'-methoxy)carboxylic acid and the systematic name about this chemical is 3'-methoxybiphenyl-4-carboxylic acid. The molecular formula about this chemical is C₁₄H₁₂O₃ and the molecular weight is 228.24. It belongs to the Pharmacetical.

Physical properties about [1,1'-Biphenyl]-4-carboxylicacid, 3'-methoxy- are: (1)ACD/LogP: 3.52; (2)ACD/LogD (pH 5.5): 2.16; (3)ACD/LogD (pH 7.4): 0.62; (4)ACD/BCF (pH 5.5): 12.06; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 84.94; (7)ACD/KOC (pH 7.4): 2.48; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 35.53Å²; (12)Index of Refraction: 1.589; (13)Molar Refractivity: 64.45 cm³; (14)Molar Volume: 191.2 cm³; (15)Polarizability: 25.55x10^-24cm³; (16)Surface Tension: 46.5 dyne/cm; (17)Enthalpy of Vaporization: 68.55 kJ/mol; (18)Boiling Point: 399.4 °C at 760 mmHg; (19)Vapour Pressure: 4.28E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c2ccc(c1cc(OC)ccc1)cc2
(2)InChI: InChI=1/C14H12O3/c1-17-13-4-2-3-12(9-13)10-5-7-11(8-6-10)14(15)16/h2-9H,1H3,(H,15,16)
(3)InChIKey: OAMJQKDGQYAQKD-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C14H12O3/c1-17-13-4-2-3-12(9-13)10-5-7-11(8-6-10)14(15)16/h2-9H,1H3,(H,15,16)
(5)Std. InChIKey: OAMJQKDGQYAQKD-UHFFFAOYSA-N

Product Name

3'-METHOXY-BIPHENYL-4-CARBOXYLIC ACID

[1,1'-Biphenyl]-4-carboxylicacid, 3'-methoxy- Specification

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