Basic information
- CAS
40029-36-5- Standard SMILES
N#C/C(=C\c1cccnc1)C(N)=O- InChIKey
HBHVANPHMSEPFC-XBXARRHUSA-N- Molecular formula
- C9H7N3O
- Average molar mass
- 173.17 g/mol
- Monoisotopic mass
- 173.05891186
Names & identifiers
- Preferred name
- (E)-2-cyano-3-pyridin-3-ylprop-2-enamide
- IUPAC
- (E)-2-cyano-3-pyridin-3-ylprop-2-enamide
- English name
- (E)-2-CYANO-3-(3-PYRIDINYL)-2-PROPENAMIDE
- Molecular formula
- C9H7N3O
- Molecular weight
- 173.17
Names & synonyms
40029-36-5(2E)-2-cyano-3-(pyridin-3-yl)prop-2-enamide(E)-2-cyano-3-pyridin-3-ylprop-2-enamideMFCD00460593136633-62-02-cyano-3-(pyridin-3-yl)prop-2-enamideCHEMBL19274992-cyano-3-(3-pyridinyl)acrylamideAKOS003851623(E)-2-cyano-3-(3-pyridyl)prop-2-enamideEN300-42713762Y-0956
Show more names
BUTTPARK 59\40-60(E)-2-CYANO-3-(3-PYRIDINYL)-2-PROPENAMIDE2-Propenamide, 2-cyano-3-(3-pyridinyl)-, (E)- (9CI)
AG-690/32522051
Database identifiers
- CAS
40029-36-5- PubChem CID
- 720200
- ChEMBL
CHEMBL1927499
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 274
Chemistry & industry
Suppliers5 total
BUTTPARK[email protected]
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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