(4-Amino-chroman-7-yl)-acetonitrile
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Basic information
- Standard SMILES
N#CCc1ccc2c(c1)OCCC2N- InChIKey
VJMWJPCPJOUSMQ-UHFFFAOYSA-N- Molecular formula
- C11H12N2O
- Average molar mass
- 188.23 g/mol
Names & identifiers
- Preferred name
- (4-Amino-chroman-7-yl)-acetonitrile
- IUPAC
- 2-(4-amino-3,4-dihydro-2H-chromen-7-yl)acetonitrile
Names & synonyms
784205-08-9SCHEMBL4141579VJMWJPCPJOUSMQ-UHFFFAOYSA-N(4-amino-chroman-7-yl)-acetonitrileDA-02792
Database identifiers
- PubChem CID
- 68929026
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 245
Related reactions
3 records
Compound notes
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