cyclopropanecarboxylic acid, 2-phenyl-, methyl ester, (1S,2R)-
Basic information
- CAS
67528-63-6- Standard SMILES
COC(=O)[C@H]1C[C@H]1c1ccccc1- InChIKey
BQRFZWGTJXCXSR-UWVGGRQHSA-N- Molecular formula
- C11H12O2
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.08372962
Names & identifiers
- Preferred name
- cyclopropanecarboxylic acid, 2-phenyl-, methyl ester, (1S,2R)-
- IUPAC
- cis-methyl (1S,2R)-2-phenylcyclopropane-1-carboxylate
Names & synonyms
67528-63-6cyclopropanecarboxylic acid, 2-phenyl-, methyl ester, (1S,2R)-DTXSID40349102methyl (1S,2R)-2-phenylcyclopropanecarboxylateRefChem:336270DTXCID60300174InChI=1/C11H12O2/c1-13-11(12)10-7-9(10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3/t9-,10-/m0/smethyl (1S,2R)-2-phenylcyclopropane-1-carboxylatemethyl cis-(1s)-2-phenylcyclo-propane-carboxylate
Database identifiers
- CAS
67528-63-6- PubChem CID
- 642983
- DTXSID
DTXSID40349102- Nikkaji
- J1.162.783H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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