Basic information
- CAS
16491-37-5- Standard SMILES
CCCC(=O)OC1CCC(C)CC1- InChIKey
QKCCZGILHFUAHN-UHFFFAOYSA-N- Molecular formula
- C11H20O2
- Average molar mass
- 184.27 g/mol
- Monoisotopic mass
- 184.14632988
Names & identifiers
- Preferred name
- 4-Methylcyclohexyl butyrate
- IUPAC
- (4-methylcyclohexyl) butanoate
- English name
- 4-methylcyclohexyl butyrate
- Molecular formula
- C11H20O2
- Molecular weight
- 184.28
Names & synonyms
4-Methylcyclohexyl butyrateEINECS 240-554-2AI3-33196DTXSID20167821Butanoic acid, 4-methylcyclohexyl esterRefChem:99865DTXCID2090312240-554-216491-37-5(4-methylcyclohexyl) butanoate4-METHYLCYCLOHEXYL BUTANOATEQKCCZGILHFUAHN-UHFFFAOYSA-N
Show more names
Butanoic acid 4-methylcyclohexyl ester
NS00025395
Database identifiers
- CAS
16491-37-5- PubChem CID
- 85452
- DTXSID
DTXSID20167821- EC Number
- 240-554-2
- Nikkaji
- J174.599I
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Chemistry & industry
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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