6-Chloro-1-hexanol

C₆H₁₃ClOCAS 2009-83-8136.62 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide

Properties

Molecular formula: C₆H₁₃ClO
Molar mass: 136.62 g/mol
Exact mass: 136.0655 Da
Density: 1.0241 g/mL (at 20 °C)
Melting point: 102 °C
Boiling point: 102.7 °C (at 11 Torr)
logP: 1.78Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 5

Hazards

Warning

H312 Harmful in contact with skin30.4% of notifiers
H315 Causes skin irritation34.2% of notifiers
H319 Causes serious eye irritation98.8% of notifiers
H332 Harmful if inhaled31.1% of notifiers

Aggregated from 161 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P317, P321, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

2009-83-8

SMILES

OCCCCCCCl

InChIKey

JNTPTNNCGDAGEJ-UHFFFAOYSA-N

InChI

InChI=1S/C6H13ClO/c7-5-3-1-2-4-6-8/h8H,1-6H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names

1-Hexanol, 6-chloro-
1-Chloro-6-hexanol
6-Chlorohexanol
Hexamethylene chlorohydrin
ω-Chlorohexanol
1-Chloro-6-hydroxyhexane
NSC 3700

Reactions

Hexamethylene chlorohydrin (1-Hexanol, 6-chloro-)product

Work with 6-Chloro-1-hexanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

8-Chloro-1-octanol23144-52-7100 % similar 5-Chloro-1-pentanol5259-98-3100 % similar 1,5-Pentanediol111-29-560 % similar 1,10-Decanediol112-47-060 % similar 1,14-Tetradecanediol19812-64-760 % similar 1,10-Dichlorodecane2162-98-360 % similar 1,8-Dichlorooctane2162-99-460 % similar 1,6-Dichlorohexane2163-00-060 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-(2-Chloroethoxy)butane10503-96-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook