C1=CN=CC=C1CC#N
CAS: 13121-99-8
Nombre: 2-pyridin-4-ylacetonitrile
SMILES: C1=CN=CC=C1CC#N

Molecular Processing

Molecular formula
C7H6N2
Molecular weight
118.14
Exact mass
118.0531
XLogP
1.15
TPSA
36.68
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
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
0.143
Molar refractivity
33.55

Supplementary Information

InChIKey: BMVSAKPRNWZCPG-UHFFFAOYSA-N
Sinónimos
13121-99-82-(PYRIDIN-4-YL)ACETONITRILEDTXSID10399437RefChem:462138DTXCID00350294816-873-34-PyridylacetonitrilePyridin-4-yl-acetonitrile4-Pyridineacetonitrile2-pyridin-4-ylacetonitrilepyridin-4-ylacetonitrileMFCD034126012-(4-Pyridyl)acetonitrile4-cyanomethyl-pyridine(Pyridin-4-yl)acetonitrileSCHEMBL254403orb2942861SCHEMBL75456682-(Pyridin-4-yl);acetonitrileBMVSAKPRNWZCPG-UHFFFAOYSA-NSTL168052TN9769AKOS000159461SB52364BS-13013SY012818DB-062808CS-0130528EN300-29628F219517
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