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Name |
Benzeneacetyl chloride, 2-chloro- |
EINECS | N/A |
CAS No. | 51512-09-5 | Density | 1.324 g/cm3 |
PSA | 17.07000 | LogP | 2.64790 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H6Cl2O | Boiling Point | 254.7 °C at 760 mmHg |
Molecular Weight | 189.041 | Flash Point | 103 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39-45 | Risk Codes | 22-29-34 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Chlorophenylacetyl chloride;o-Chlorophenylacetylchloride;2-Chlorophenylacetyl chloride,97%; |
Article Data | 64 |
The CAS register number of Benzeneacetyl chloride, 2-chloro- is 51512-09-5. The IUPAC name about this chemical is 2-(2-chlorophenyl)acetyl chloride. The molecular formula about this chemical is C8H6Cl2O and the molecular weight is 189.03864.
Physical properties about Benzeneacetyl chloride, 2-chloro- are: (1)ACD/LogP: 2.83; (2)ACD/LogD (pH 5.5): 2.83; (3)ACD/LogD (pH 7.4): 2.83; (4)ACD/BCF (pH 5.5): 83.16; (5)ACD/BCF (pH 7.4): 83.16; (6)ACD/KOC (pH 5.5): 823.93; (7)ACD/KOC (pH 7.4): 823.93; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07 Å2; (11)Index of Refraction: 1.551; (12)Molar Refractivity: 45.57 cm3; (13)Molar Volume: 142.7 cm3; (14)Polarizability: 18.06x10-24cm3; (15)Surface Tension: 41.9 dyne/cm; (16)Density: 1.324 g/cm3; (17)Flash Point: 103 °C; (18)Enthalpy of Vaporization: 49.21 kJ/mol; (19)Boiling Point: 254.7 °C at 760 mmHg; (20)Vapour Pressure: 0.017 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccccc1CC(Cl)=O
(2)InChI: InChI=1/C8H6Cl2O/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2
(3)InChIKey: WIHSAOYVGKVRJX-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H6Cl2O/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2
(5)Std. InChIKey: WIHSAOYVGKVRJX-UHFFFAOYSA-N