3-(3-Iodo-phenylamino)-propionitrile

HCID 19081634
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Basic information

Standard SMILES
N#CCCNc1cccc(I)c1
InChIKey
OSWBKOALNLPAHY-UHFFFAOYSA-N
Molecular formula
C9H9IN2
Average molar mass
272.09 g/mol

Names & identifiers

Preferred name
3-(3-Iodo-phenylamino)-propionitrile
IUPAC
3-(3-iodoanilino)propanenitrile

Names & synonyms

SCHEMBL7124982OSWBKOALNLPAHY-UHFFFAOYSA-N3-(3-iodo-phenylamino)-propionitrileAKOS009052192

Database identifiers

PubChem CID
19081634

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
35.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12

Related reactions

4 records
New reaction record

Linked notes

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