C1=CC=C(C=C1)NCCC#N
CAS: 1075-76-9
Nombre: 3-anilinopropanenitrile
SMILES: C1=CC=C(C=C1)NCCC#N

Molecular Processing

Molecular formula
C9H10N2
Molecular weight
146.19
Exact mass
146.0844
XLogP
2.01
TPSA
35.82
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
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
0.222
Molar refractivity
45.16

Supplementary Information

InChIKey: FENJKTQEFUPECW-UHFFFAOYSA-N
Sinónimos
3-Anilinopropionitrile3-(phenylamino)propanenitrile3-AnilinopropanenitrilePropanenitrile, 3-(phenylamino)-3-(phenylamino)propionitrile3-Phenylamino-propionitrileEINECS 214-057-6BRN 0509166S4YM38H4U6AI3-52560NSC-80663UNII-S4YM38H4U6Aniline, N-beta-cyanoethyl-DTXSID8051548FENJKTQEFUPECW-UHFFFAOYSA-4-12-00-00890 (Beilstein Handbook Reference)3-(N-PHENYLAMINO)PROPIONITRILERefChem:93013DTXCID6030100214-057-6FENJKTQEFUPECW-UHFFFAOYSA-NInChI=1/C9H10N2/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6,11H,4,8H21075-76-9N-(2-Cyanoethyl)anilineN-(Cyanoethyl)anilinebeta-AnilinopropionitrilePROPIONITRILE, 3-ANILINO-2-PhenylaminopropionitrilePropanenitrile, 3-anilino-.beta.-Anilinopropionitrile
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