Benzene,1-chloro-4-[(1E)-3-chloro-1-propenyl]- supplier

Name
Benzene,1-chloro-4-[(1E)-3-chloro-1-propenyl]-
EINECS
CAS No. 103979-29-9
Article Data21
CAS DataBase
Density 1.216 g/cm³
Solubility
Melting Point
Formula C₉H₈Cl₂
Boiling Point 281.6 °C at 760 mmHg
Molecular Weight 187.069
Flash Point 127.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzene,1-chloro-4-(3-chloro-1-propenyl)-, (E)-;trans-3-(4-Chlorophenyl)-2-propenyl chloride;
PSA
LogP

Benzene,1-chloro-4-[(1E)-3-chloro-1-propenyl]- Specification

The Benzene, 1-chloro-4-[(1E)-3-chloro-1-propenyl]-, with the CAS registry number 103979-29-9, is also known as Benzene, 1-chloro-4-(3-chloro-1-propenyl)-, (E)-. This chemical's molecular formula is C₉H₈Cl₂ and molecular weight is 187.0658. What's more, its systematic name is 1-Chloro-4-[(1E)-3-chloroprop-1-en-1-yl]benzene.

Physical properties about Benzene, 1-chloro-4-[(1E)-3-chloro-1-propenyl]- are: (1)ACD/LogP: 3.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.68; (4)ACD/LogD (pH 7.4): 3.68; (5)ACD/BCF (pH 5.5): 369.16; (6)ACD/BCF (pH 7.4): 369.16; (7)ACD/KOC (pH 5.5): 2394.5; (8)ACD/KOC (pH 7.4): 2394.5; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.59; (14)Molar Refractivity: 51.88 cm³; (15)Molar Volume: 153.7 cm³; (16)Polarizability: 20.56×10^-24 cm³; (17)Surface Tension: 39.1 dyne/cm; (18)Density: 1.216 g/cm³; (19)Flash Point: 127.9 °C; (20)Enthalpy of Vaporization: 49.95 kJ/mol; (21)Boiling Point: 281.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00602 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc(/C=C/CCl)cc1
(2) InChI: InChI=1/C9H8Cl2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-6H,7H2/b2-1+
(3) InChIKey: CLZRDHUBODXICN-OWOJBTEDBF

Product Name

Benzene,1-chloro-4-[(1E)-3-chloro-1-propenyl]-

Benzene,1-chloro-4-[(1E)-3-chloro-1-propenyl]- Specification

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