Ethanone,1-(4'-chloro[1,1'-biphenyl]-4-yl)- supplier

Name
1-(4'-CHLORO-BIPHENYL-4-YL)-ETHANONE
EINECS
CAS No. 5002-07-3
Article Data100
CAS DataBase
Density 1.163 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₁ClO
Boiling Point 353.2 °C at 760 mmHg
Molecular Weight 230.694
Flash Point 193.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Acetophenone,4'-(p-chlorophenyl)- (6CI,7CI,8CI);1-(4'-Chloro[1,1'-biphenyl]-4-yl)ethanone;4-Acetyl-4'-chlorobiphenyl;4'-(4-Chlorophenyl)acetophenone;4'-Chloro-4-acetylbiphenyl;
PSA 17.07000
LogP 4.20960

Ethanone,1-(4'-chloro[1,1'-biphenyl]-4-yl)- Specification

The CAS register number of Ethanone,1-(4'-chloro[1,1'-biphenyl]-4-yl)- is 5002-07-3. It also can be called as 4-Acetyl-4'-chlorobiphenyl and the systematic name about this chemical is 1-(4'-chlorobiphenyl-4-yl)ethanone. The molecular formula about this chemical is C₁₄H₁₁ClO and the molecular weight is 230.69. This chemical is irritant. It may cause inflammation to the skin or other mucous membranes.

Physical properties about Ethanone,1-(4'-chloro[1,1'-biphenyl]-4-yl)- are: (1)ACD/LogP: 4.08; (2)ACD/LogD (pH 5.5): 4.08; (3)ACD/LogD (pH 7.4): 4.08; (4)ACD/BCF (pH 5.5): 744.56; (5)ACD/BCF (pH 7.4): 744.56; (6)ACD/KOC (pH 5.5): 3956.46; (7)ACD/KOC (pH 7.4): 3956.46; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07 Å²; (11)Index of Refraction: 1.577; (12)Molar Refractivity: 65.76 cm³; (13)Molar Volume: 198.1 cm³; (14)Polarizability: 26.07x10^-24cm³; (15)Surface Tension: 41 dyne/cm; (16)Density: 1.163 g/cm³; (17)Flash Point: 193.2 °C; (18)Enthalpy of Vaporization: 59.81 kJ/mol; (19)Boiling Point: 353.2 °C at 760 mmHg; (20)Vapour Pressure: 3.65E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(c1ccc(C(=O)C)cc1)cc2
(2)InChI: InChI=1/C14H11ClO/c1-10(16)11-2-4-12(5-3-11)13-6-8-14(15)9-7-13/h2-9H,1H3
(3)InChIKey: NPGUSEJJJVVVME-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C14H11ClO/c1-10(16)11-2-4-12(5-3-11)13-6-8-14(15)9-7-13/h2-9H,1H3
(5)Std. InChIKey: NPGUSEJJJVVVME-UHFFFAOYSA-N

Product Name

1-(4'-CHLORO-BIPHENYL-4-YL)-ETHANONE

Ethanone,1-(4'-chloro[1,1'-biphenyl]-4-yl)- Specification

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