[1,1'-Biphenyl]-4-aceticacid, 2'-chloro- supplier

Name
(2'-CHLORO-BIPHENYL-4-YL)-ACETIC ACID
EINECS
CAS No. 5001-98-9
Density 1.27 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₁ClO₂
Boiling Point 399.8 °C at 760 mmHg
Molecular Weight 246.69
Flash Point 195.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Biphenylaceticacid, 2'-chloro- (8CI);Acetic acid, (2'-chloro-4-biphenylyl)- (7CI);F 2006;
PSA 37.30000
LogP 3.63410

[1,1'-Biphenyl]-4-aceticacid, 2'-chloro- Specification

The CAS register number of [1,1'-Biphenyl]-4-aceticacid, 2'-chloro- is 5001-98-9. It also can be called as 4-Biphenylaceticacid, 2'-chloro- (8CI) and the systematic name about this chemical is (2'-chlorobiphenyl-4-yl)acetic acid. The molecular formula about this chemical is C₁₄H₁₁ClO₂ and the molecular weight is 246.69.

Physical properties about [1,1'-Biphenyl]-4-aceticacid, 2'-chloro- are: (1)ACD/LogP: 3.74; (2)ACD/LogD (pH 5.5): 2.44; (3)ACD/LogD (pH 7.4): 0.67; (4)ACD/BCF (pH 5.5): 20.65; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 130.04; (7)ACD/KOC (pH 7.4): 2.18; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 26.3 Å²; (12)Index of Refraction: 1.604; (13)Molar Refractivity: 66.85 cm³; (14)Molar Volume: 194.1 cm³; (15)Polarizability: 26.5x10^-24cm³; (16)Surface Tension: 49.5 dyne/cm; (17)Density: 1.27 g/cm³; (18)Flash Point: 195.6 °C; (19)Enthalpy of Vaporization: 68.61 kJ/mol; (20)Boiling Point: 399.8 °C at 760 mmHg; (21)Vapour Pressure: 4.14E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccccc2c1ccc(cc1)CC(=O)O
(2)InChI: InChI=1/C14H11ClO2/c15-13-4-2-1-3-12(13)11-7-5-10(6-8-11)9-14(16)17/h1-8H,9H2,(H,16,17)
(3)InChIKey: QCNVQJYOSMHROS-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C14H11ClO2/c15-13-4-2-1-3-12(13)11-7-5-10(6-8-11)9-14(16)17/h1-8H,9H2,(H,16,17)
(5)Std. InChIKey: QCNVQJYOSMHROS-UHFFFAOYSA-N

Product Name

(2'-CHLORO-BIPHENYL-4-YL)-ACETIC ACID

[1,1'-Biphenyl]-4-aceticacid, 2'-chloro- Specification

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