Basic information
- Standard SMILES
CCOC(=O)C(C#N)=C(C)OCC- InChIKey
YKXFOGAYPIPTKF-UHFFFAOYSA-N- Molecular formula
- C9H13NO3
- Average molar mass
- 183.2 g/mol
- Monoisotopic mass
- 183.08954328
Names & identifiers
- Preferred name
- Ethyl 2-cyano-3-ethoxy-2-butenoate
- IUPAC
- ethyl 2-cyano-3-ethoxybut-2-enoate
Names & synonyms
ethyl 2-cyano-3-ethoxy-2-butenoateDTXSID50275504RefChem:342761DTXCID60226941932750-29-3ethyl 2-cyano-3-ethoxybut-2-enoate2-cyano-3-ethoxy-but-2-enoic acid ethyl esterSCHEMBL238244YKXFOGAYPIPTKF-UHFFFAOYSA-NMFCD09966054ethyl 2-cyano-3-ethoxy-but-2-enoateethyl 2-cyano-3-ethoxy-3-methylacrylate
Show more names
SY341805Ethyl (Z)-2-Cyano-3-ethoxy-2-butenoateD87812F870172
Database identifiers
- CAS
932750-29-3- PubChem CID
- 46635
- DTXSID
DTXSID50275504- EC Number
- 678-773-4
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 259
Related reactions
18 records
Linked notes
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