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Basic Information
CAS No.: 24165-66-0
Name: 1-(2-CHLOROPHENYL)-3-BUTEN-1-OL 97
Molecular Structure:
Molecular Structure of 24165-66-0 (1-(2-CHLOROPHENYL)-3-BUTEN-1-OL 97)
Formula: C10H11ClO
Molecular Weight: 182.65
Synonyms: 1-(2-CHLOROPHENYL)-3-BUTEN-1-OL 97;1-(2-chlorophenyl)but-3-en-1-ol
Density: 1.137 g/cm3
Melting Point: 31-35 °C(lit.)
Boiling Point: 273.3 °C at 760mmHg
Flash Point: 119.1 °C
PSA: 20.23000
LogP: 2.94950
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Specification

The IUPAC name of this chemical is 1-(2-Chlorophenyl)but-3-en-1-ol. With the CAS registry number of 24165-66-0, it is also called 1-(2-Chlorophenyl)-3-buten-1-ol 97. In addition, the formula is C10H11ClO and the molecular weight is 182.6467.

Physical properties about 1-(2-Chlorophenyl)but-3-en-1-ol are: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.55; (8)Molar Refractivity: 51.22 cm3; (9)Molar Volume: 160.5 cm3; (10)Polarizability: 20.3×10-24 cm3; (11)Surface Tension: 39.9 dyne/cm; (12)Density: 1.137 g/cm3; (13)Flash Point: 119.1 °C; (14)Enthalpy of Vaporization: 54.04 kJ/mol; (15)Boiling Point: 273.3 °C at 760 mmHg; (16)Vapour Pressure: 0.00282 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:Clc1ccccc1C(O)C\C=C
(2)InChI:InChI=1/C10H11ClO/c1-2-5-10(12)8-6-3-4-7-9(8)11/h2-4,6-7,10,12H,1,5H2
(3)InChIKey:BFIIUQFVPDIOLQ-UHFFFAOYAK
(4)Std. InChI:InChI=1S/C10H11ClO/c1-2-5-10(12)8-6-3-4-7-9(8)11/h2-4,6-7,10,12H,1,5H2
(5)Std. InChIKey:BFIIUQFVPDIOLQ-UHFFFAOYSA-N