2-Chlorohexane (C6H13Cl)

2-Chlorohexane (C6H13Cl; CAS 638-28-8) is a practical retrosynthesis target. 2-Chlorohexane presents a C6 framework, halogen substitution. Open AI route search in one click below.

Target: 2-Chlorohexane
CAS: 638-28-8
Formula: C6H13Cl
Approx. MW: 120.62
SMILES: CCCCC(C)Cl
PubChem CID: 12521
Approx. carbons: C6

2-Chlorohexane structure

Properties

IUPAC name: 2-chlorohexane
Common names: 2-CHLOROHEXANE; 638-28-8; Hexane, 2-chloro-; EINECS 211-329-6; DTXSID00867751; RefChem:786321; DTXCID40815913; 211-329-6; 2-chloro-hexane; 2-Hexyl chloride
Molecular weight: 120.62
Exact mass: 120.07
InChIKey: GLCIPJOIEVLTPR-UHFFFAOYSA-N

View on PubChem

2-Chlorohexane 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 2-Chlorohexane?

2-Chlorohexane has molecular formula C6H13Cl. Molecular weight about 120.62 g·mol⁻¹.

What is the CAS number of 2-Chlorohexane?

The CAS Registry Number for 2-Chlorohexane is 638-28-8.

Run AI retrosynthesis for 2-Chlorohexane Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H13Cl.

Related targets

Similar compounds

1-Chlorohexane 3-(Chloromethyl)pentane 3-Chlorohexane 1-Bromo-2-ethylbutane 1-Bromo-6-chlorohexane 1-Bromohexane

Browse the full target catalog

References & tools

ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.