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154885-33-3

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Basic Information
CAS No.: 154885-33-3
Name: (R)-6-CHLORO-2-HEXANOL
Article Data: 2
Molecular Structure:
Molecular Structure of 154885-33-3 ((R)-6-CHLORO-2-HEXANOL)
Formula: C6H13ClO
Molecular Weight: 136.622
Synonyms: (R)-6-Chloro-2-hexanol;(R)-6-Chloro-2-hexanol, 98+%;
Density: 0.998 g/cm3
Boiling Point: 190.4 °C at 760 mmHg
Flash Point: 86.5 °C
Appearance: Clear colorless to light yellow liquid
Hazard Symbols: Xn
Risk Codes: R22
PSA: 20.23000
LogP: 1.77630
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Specification

The CAS register number of 2-Hexanol, 6-chloro-,(R)- (9CI) is 154885-33-3. It also can be called as (R)-6-Chloro-2-hexanol and the IUPAC name about this chemical is (2R)-6-chlorohexan-2-ol. The molecular formula about this chemical is C6H13ClO and the molecular weight is 136.62. It belongs to the following product categories which include Alcohols, Hydroxy Esters and Derivatives; Chiral Compounds and so on. The storage temperature of this chemical is 2-8 °C.

Physical properties about 2-Hexanol, 6-chloro-,(R)- (9CI) are: (1)ACD/LogP: 1.44; (2)ACD/LogD (pH 5.5): 1.44; (3)ACD/LogD (pH 7.4): 1.44; (4)ACD/BCF (pH 5.5): 7.27; (5)ACD/BCF (pH 7.4): 7.27; (6)ACD/KOC (pH 5.5): 144; (7)ACD/KOC (pH 7.4): 144; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.441; (13)Molar Refractivity: 36.18 cm3; (14)Molar Volume: 136.8 cm3; (15)Polarizability: 14.34x10-24cm3; (16)Surface Tension: 31.2 dyne/cm; (17)Density: 0.998 g/cm3; (18)Flash Point: 86.5 °C; (19)Enthalpy of Vaporization: 49.65 kJ/mol; (20)Boiling Point: 190.4 °C at 760 mmHg; (21)Vapour Pressure: 0.147 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCCCC[C@H](O)C
(2)InChI: InChI=1/C6H13ClO/c1-6(8)4-2-3-5-7/h6,8H,2-5H2,1H3/t6-/m1/s1
(3)InChIKey: LDIPECSHAACCTQ-ZCFIWIBFBJ
(4)Std. InChI: InChI=1S/C6H13ClO/c1-6(8)4-2-3-5-7/h6,8H,2-5H2,1H3/t6-/m1/s1
(5)Std. InChIKey: LDIPECSHAACCTQ-ZCFIWIBFSA-N