Basic information
- CAS
102571-14-2- Standard SMILES
CCN(CC)CCOC(=O)C(O)(Cc1ccccc1)C1CC1- InChIKey
PQTAVXNCLQMLJA-UHFFFAOYSA-N- Molecular formula
- C18H27NO3
- Average molar mass
- 305.4 g/mol
- Monoisotopic mass
- 305.19909372
Names & identifiers
- Preferred name
- Cyclopropaneglycolic acid, alpha-benzyl-, 2-(diethylamino)ethyl ester
- IUPAC
- 2-(diethylamino)ethyl 2-cyclopropyl-2-hydroxy-3-phenylpropanoate
Names & synonyms
102571-14-2CYCLOPROPANEGLYCOLIC ACID, alpha-BENZYL-, 2-(DIETHYLAMINO)ETHYL ESTERRefChem:10827812-(Diethylamino)ethyl benzylcyclopropylglycolatealpha-Benzylcyclopropaneglycolic acid 2-(diethylamino)ethyl ester2-(diethylamino)ethyl 2-cyclopropyl-2-hydroxy-3-phenylpropanoateDTXSID10907733
Database identifiers
- CAS
102571-14-2- PubChem CID
- 59489
- DTXSID
DTXSID10907733- Nikkaji
- J85.265A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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