Basic information
- CAS
84731-69-1- Standard SMILES
CCCCOC(=O)C1CCC(C(C)(C)C)CC1- InChIKey
JAJKHHAYOBZFSU-UHFFFAOYSA-N- Molecular formula
- C15H28O2
- Average molar mass
- 240.38 g/mol
- Monoisotopic mass
- 240.20893013
Names & identifiers
- Preferred name
- Butyl 4-(1,1-dimethylethyl)cyclohexanecarboxylate
- IUPAC
- butyl 4-tert-butylcyclohexane-1-carboxylate
- English name
- butyl 4-(1,1-dimethylethyl)cyclohexanecarboxylate
- Molecular formula
- C15H28O2
- Molecular weight
- 240.38162
Names & synonyms
84731-69-1Butyl 4-(1,1-dimethylethyl)cyclohexanecarboxylateEINECS 283-828-7DTXSID60233751RefChem:122214DTXCID90156242283-828-7butyl 4-tert-butylcyclohexane-1-carboxylateJAJKHHAYOBZFSU-UHFFFAOYSA-NNS000386394-(1,1-Dimethylethyl)cyclohexanecarboxylic acid butyl ester
Database identifiers
- CAS
84731-69-1- PubChem CID
- 3020105
- DTXSID
DTXSID60233751- EC Number
- 283-828-7
- Nikkaji
- J309.119H
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 232
Chemistry & industry
Suppliers1 total
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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