(2E)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
Basic information
- CAS
83677-19-4- Standard SMILES
CC(C)(C)c1cc(/C=C(\C#N)C(N)=O)cc(C(C)(C)C)c1O- InChIKey
GUBROJUTOMZSOC-KPKJPENVSA-N- Molecular formula
- C18H24N2O2
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.18377801
Names & identifiers
- Preferred name
- (2E)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
- IUPAC
- (E)-2-cyano-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enamide
Names & synonyms
(2E)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamideRefChem:1049765beta-Carbamoyl-beta-cyano-3,5-di-tert-butyl-4-hydroxystyrene83677-19-42-Propenamide, 3-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)-2-cyano-3-(3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)-2-cyano-2-propenamidebenzylidenemalononitrile (BMN) deriv. 45BDBM4361CHEMBL490570SCHEMBL11093690AKOS024367844ST51001882
Show more names
(2E)-3-[3,5-bis(tert-butyl)-4-hydroxyphenyl]-2-cyanoprop-2-enamide
Database identifiers
- CAS
83677-19-4- PubChem CID
- 5328802
- ChEMBL
CHEMBL490570- Nikkaji
- J519.989A
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…