Basic information
- CAS
101068-39-7- Standard SMILES
O=C(Oc1ccccc1Cl)C1CCCCC1- InChIKey
CVAIHALBNQCWTA-UHFFFAOYSA-N- Molecular formula
- C13H15ClO2
- Average molar mass
- 238.71 g/mol
- Monoisotopic mass
- 238.0760574
Names & identifiers
- Preferred name
- 2-Chlorophenyl cyclohexanecarboxylate
- IUPAC
- (2-chlorophenyl) cyclohexanecarboxylate
Names & synonyms
2-Chlorophenyl cyclohexanecarboxylate101068-39-7DTXSID00339741RefChem:259542DTXCID40290822Cyclohexanecarboxylic acid, 2-chlorophenyl ester(2-chlorophenyl) cyclohexanecarboxylateHMS1594C13CVAIHALBNQCWTA-UHFFFAOYSA-NAKOS0023513212-Chlorophenyl cyclohexanecarboxylate #F3098-7525
Database identifiers
- CAS
101068-39-7- PubChem CID
- 558201
- DTXSID
DTXSID00339741
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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