(4-Amino-chroman-7-yl)-acetonitrile

HCID 68929026
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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 properties

XLogP
0.6
Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14

Related reactions

3 records
New reaction record

Linked notes

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