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4-Aminobenzonitrile

Catalog Number
ACM873745
Product Name
4-Aminobenzonitrile
Structure
CAS
873-74-5
Category
Liquid Crystal (LC) Building Blocks
IUPAC Name
4-aminobenzonitrile
Molecular Weight
118.14g/mol
Molecular Formula
C7H6N2
Canonical SMILES
C1=CC(=CC=C1C#N)N
InChI
InChI=1S/C7H6N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,9H2
InChI Key
YBAZINRZQSAIAY-UHFFFAOYSA-N
Melting Point
84.0 °C
Complexity
125
Covalently-Bonded Unit Count
1
EC Number
212-850-1
Exact Mass
118.053098g/mol
Formal Charge
0
Heavy Atom Count
9
MeSH Entry Terms
4-aminobenzonitrile;p-aminobenzonitrile;para-aminobenzonitrile
Monoisotopic Mass
118.053098g/mol
NSC Number
7625
Rotatable Bond Count
0
UNII
PB8V69Y76T
XLogP3
1.3
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