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Basic information
- Standard SMILES
N#CCCC1Cc2cc(N)ccc2O1- InChIKey
YCSWTDJCZQSVPU-UHFFFAOYSA-N- Molecular formula
- C11H12N2O
- Average molar mass
- 188.23 g/mol
Names & identifiers
- Preferred name
- 5-Amino-2-cyanoethyl-2,3-dihydrobenzofuran
- IUPAC
- 3-(5-amino-2,3-dihydro-1-benzofuran-2-yl)propanenitrile
Names & synonyms
SCHEMBL8425149YCSWTDJCZQSVPU-UHFFFAOYSA-N5-Amino-2-cyanoethyl-2,3-dihydrobenzofuran
Database identifiers
- PubChem CID
- 54501488
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 245
Related reactions
2 records
Compound notes
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