Cyclohexanol, pentyl-, acetate
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Basic information
- CAS
85665-91-4- Standard SMILES
CCCCCC1(OC(C)=O)CCCCC1- InChIKey
PXKHJCMKWLCRFQ-UHFFFAOYSA-N- Molecular formula
- C13H24O2
- Average molar mass
- 212.33 g/mol
- Monoisotopic mass
- 212.17763
Names & identifiers
- Preferred name
- Cyclohexanol, pentyl-, acetate
- IUPAC
- (1-pentylcyclohexyl) acetate
- English name
- pentylcyclohexyl acetate
- Molecular formula
- C13H24O2
- Molecular weight
- 212.32846
Names & synonyms
Cyclohexanol, pentyl-, acetate85665-91-4EINECS 288-181-4DTXSID90234938RefChem:129638DTXCID20157429Pentylcyclohexyl acetate1-PENTYLCYCLOHEXYL ACETATESCHEMBL1516643PXKHJCMKWLCRFQ-UHFFFAOYSA-NNS00039033AMYLCYCLOHEXYLACETATE
Show more names
(1-pentylcyclohexyl) acetate
Database identifiers
- CAS
85665-91-4- PubChem CID
- 198618
- DTXSID
DTXSID90234938- EC Number
- 288-181-4
- Nikkaji
- J174.572G
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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