6-(Cyclohex-2-en-1-yl)hexanoic acid
Basic information
- CAS
2105-35-3- Standard SMILES
O=C(O)CCCCCC1C=CCCC1- InChIKey
JXGPHIPNFIBBFR-UHFFFAOYSA-N- Molecular formula
- C12H20O2
- Average molar mass
- 196.29 g/mol
- Monoisotopic mass
- 196.14632988
Names & identifiers
- Preferred name
- 6-(Cyclohex-2-en-1-yl)hexanoic acid
- IUPAC
- 6-cyclohex-2-en-1-ylhexanoic acid
Names & synonyms
2105-35-36-(cyclohex-2-en-1-yl)hexanoic acidNSC3861SCHEMBL11805747NSC-3861
Database identifiers
- CAS
2105-35-3- PubChem CID
- 220718
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
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Compound notes
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