1-Chloro-4-carbomethoxy cyclohexane

HCID 21281591
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C1CCC(Cl)CC1
InChIKey
GFNLBWRMYKRHGZ-UHFFFAOYSA-N
Molecular formula
C8H13ClO2
Average molar mass
176.64 g/mol

Names & identifiers

Preferred name
1-Chloro-4-carbomethoxy cyclohexane
IUPAC
methyl 4-chlorocyclohexane-1-carboxylate

Names & synonyms

SCHEMBL10681039GFNLBWRMYKRHGZ-UHFFFAOYSA-N1-chloro-4-carbomethoxy cyclohexane1-chloro-4-carbomethoxy-cyclohexaneMethyl 4-chlorocyclohexanecarboxylate

Database identifiers

PubChem CID
21281591

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

Related reactions

3 records
New reaction record

Linked notes

Loading…