Basic information
- CAS
893755-05-0- Standard SMILES
COCCOC(=O)C(C#N)=Cc1ccccc1Cl- InChIKey
YZGHELONOWZCEE-UHFFFAOYSA-N- Molecular formula
- C13H12ClNO3
- Average molar mass
- 265.69 g/mol
- Monoisotopic mass
- 265.0505709
Names & identifiers
- Preferred name
- 2-Methoxyethyl 3-(2-chlorophenyl)-2-cyanoprop-2-enoate
- IUPAC
- 2-methoxyethyl 3-(2-chlorophenyl)-2-cyanoprop-2-enoate
Names & synonyms
2-Methoxyethyl 3-(2-chlorophenyl)-2-cyano-2-propenoate2-methoxyethyl 3-(2-chlorophenyl)-2-cyanoprop-2-enoateDTXSID501209852AKOS003594687893755-05-0
Database identifiers
- CAS
893755-05-0- PubChem CID
- 4778438
- DTXSID
DTXSID501209852
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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