Ethyl 2-(1-cyclohexenyl)butanoate
Basic information
- CAS
51632-40-7- Standard SMILES
CCOC(=O)C(CC)C1=CCCCC1- InChIKey
ZVLKCNVKMAUQOB-UHFFFAOYSA-N- Molecular formula
- C12H20O2
- Average molar mass
- 196.29 g/mol
- Monoisotopic mass
- 196.14632988
Names & identifiers
- Preferred name
- Ethyl 2-(1-cyclohexenyl)butanoate
- IUPAC
- ethyl 2-(cyclohexen-1-yl)butanoate
- English name
- 2-Cyclohex-1-enyl-butyric acid ethyl ester
- Molecular formula
- C12H20O2
- Molecular weight
- 196.29
Names & synonyms
51632-40-7ETHYL 2-(1-CYCLOHEXENYL)BUTANOATEDTXSID50303891RefChem:342340DTXCID50255023ethyl 2-(cyclohex-1-en-1-yl)butanoate2-Cyclohex-1-Enyl-Butyric Acid Ethyl EsterNSC163290SCHEMBL10954993AKOS006345511ethyl 2-(1-cyclohexen-1-yl)butanoateNSC-163290
Show more names
ZVLKCNVKMAUQOB-UHFFFAOYSA-NETHYL 2-(1-CYCLOHEXENYL)BUTYRATE1-Cyclohexene-1-acetic acid, α-ethyl-, ethyl ester
Database identifiers
- CAS
51632-40-7- PubChem CID
- 294553
- DTXSID
DTXSID50303891
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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