Basic information
- CAS
60128-02-1- Standard SMILES
CCCCCOC(=O)C1CC1- InChIKey
OFBLCGQOAVRVFZ-UHFFFAOYSA-N- Molecular formula
- C9H16O2
- Average molar mass
- 156.22 g/mol
- Monoisotopic mass
- 156.11502975
Names & identifiers
- Preferred name
- Pentyl cyclopropanecarboxylate
- IUPAC
- pentyl cyclopropanecarboxylate
- English name
- Cyclopropanecarboxylic acid pentyl ester
- Molecular formula
- C9H16O2
- Molecular weight
- 156.22
Names & synonyms
Pentyl cyclopropanecarboxylate60128-02-1Cyclopropanecarboxylic acid pentyl esterSCHEMBL1553673Pentyl cyclopropanecarboxylate #OFBLCGQOAVRVFZ-UHFFFAOYSA-NDTXSID701032071Cyclopropanecarboxylic acid,pentyl ester
Database identifiers
- CAS
60128-02-1- PubChem CID
- 549673
- DTXSID
DTXSID701032071- Nikkaji
- J191.644K
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 128
Experimental & physicochemical properties
SpringerMaterials PropertiesSurface tension
Physicochemical properties
- Boiling point
- 195.6 · 195.6±8.0 °C(Predicted)
- Density
- 0.995 · 0.995±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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