Basic information
- Standard SMILES
O=C(O)C1CCC(OCC2CC2)CC1- InChIKey
QMPPWCZYUNLDGY-UHFFFAOYSA-N- Molecular formula
- C11H18O3
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.12559443
Names & identifiers
- Preferred name
- 4-[(Cyclopropylmethyl)oxy]cyclohexanecarboxylic acid
- IUPAC
- 4-(cyclopropylmethoxy)cyclohexane-1-carboxylic acid
Names & synonyms
4-[(Cyclopropylmethyl)oxy]cyclohexanecarboxylic acid4-(cyclopropylmethoxy)cyclohexane-1-carboxylic acid1134198-04-1SCHEMBL3017750QMPPWCZYUNLDGY-MGCOHNPYSA-NQMPPWCZYUNLDGY-UHFFFAOYSA-NA1-07231trans 4-[(cyclopropylmethyl)oxy]cyclohexanecarboxylic acid
Database identifiers
- PubChem CID
- 59444159
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 203
Related reactions
4 records
Compound notes
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