Ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexanecarboxylate
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Basic information
- CAS
503427-51-8- Standard SMILES
CCOC(=O)C1(c2ccccc2)CCC(CCC(C#N)(c2ccccc2)c2ccccc2)CC1- InChIKey
FWYFRNKQKPHGLN-UHFFFAOYSA-N- Molecular formula
- C31H33NO2
- Average molar mass
- 451.6 g/mol
- Monoisotopic mass
- 451.2511293
Names & identifiers
- Preferred name
- Ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexanecarboxylate
- IUPAC
- ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexane-1-carboxylate
- English name
- ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexanecarboxylate
- Molecular formula
- C31H33NO2
- Molecular weight
- 451.59922
Names & synonyms
ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexanecarboxylateOprea1_294163ethyl 4-(3-cyano-3,3-diphenylpropyl)-1-phenylcyclohexane-1-carboxylateAE-641/30154036
Database identifiers
- CAS
503427-51-8- PubChem CID
- 3271302
Properties
Computed structural propertiesFilling in
- XLogP
- 7.5
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 661
Related reactions
0 records
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Compound notes
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