C1=CC(=CC(=C1)N)C=CC#N
Name: 3-(3-aminophenyl)prop-2-enenitrile
SMILES: C1=CC(=CC(=C1)N)C=CC#N

Molecular Processing

Molecular formula
C9H8N2
Molecular weight
144.18
Exact mass
144.0687
XLogP
1.81
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
45.5

Supplementary Information

InChIKey: CVKITALHWMTERN-UHFFFAOYSA-N
Synonyme
SCHEMBL3043805CVKITALHWMTERN-UHFFFAOYSA-N3-(3-Amino-phenyl)-acrylonitrileAKOS030239821
Quelle anzeigen →
An 20 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→