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Name |
Benzofuran,4-chloro-2,3-dihydro- |
EINECS | N/A |
CAS No. | 289058-20-4 | Density | 1.272 g/cm3 |
PSA | 9.23000 | LogP | 2.27490 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H7ClO | Boiling Point | 232.7 °C at 760 mmHg |
Molecular Weight | 154.596 | Flash Point | 99.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-chloro-2,3-dihydro-1-benzofuran;4-Chloro-2,3-dihydrobenzofuran;benzofuran, 4-chloro-2,3-dihydro-; |
Article Data | 2 |
The Benzofuran,4-chloro-2,3-dihydro-, with the CAS registry number 289058-20-4, has the systematic name of 4-chloro-2,3-dihydro-1-benzofuran. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C8H7ClO.
The characteristics of Benzofuran,4-chloro-2,3-dihydro- are as followings: (1)ACD/LogP: 2.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.97; (4)ACD/LogD (pH 7.4): 2.97; (5)ACD/BCF (pH 5.5): 105.9; (6)ACD/BCF (pH 7.4): 105.9; (7)ACD/KOC (pH 5.5): 979.56; (8)ACD/KOC (pH 7.4): 979.56; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: Å2; (13)Index of Refraction: 1.577; (14)Molar Refractivity: 40.31 cm3; (15)Molar Volume: 121.5 cm3; (16)Polarizability: 15.98×10-24cm3; (17)Surface Tension: 44.5 dyne/cm; (18)Density: 1.272 g/cm3; (19)Flash Point: 99.4 °C; (20)Enthalpy of Vaporization: 45.03 kJ/mol; (21)Boiling Point: 232.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0885 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc2cccc1OCCc12
(2)InChI: InChI=1/C8H7ClO/c9-7-2-1-3-8-6(7)4-5-10-8/h1-3H,4-5H2
(3)InChIKey: NLPBTJNIFVSZLK-UHFFFAOYAU