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Home > Pyridines > 114021-49-7
114021-49-7 | 2-Propenenitrile, 3-phenyl-3-(2-pyridinyl)-
CAS No: 114021-49-7 Catalog No: AG000AC0 MDL No:MFCD18762049
Product Description
Catalog Number:
AG000AC0
Chemical Name:
2-Propenenitrile, 3-phenyl-3-(2-pyridinyl)-
CAS Number:
114021-49-7
Molecular Formula:
C14H10N2
Molecular Weight:
206.2426
MDL Number:
MFCD18762049
IUPAC Name:
3-phenyl-3-pyridin-2-ylprop-2-enenitrile
InChI:
InChI=1S/C14H10N2/c15-10-9-13(12-6-2-1-3-7-12)14-8-4-5-11-16-14/h1-9,11H
InChI Key:
KWPXHYVLHRGPLK-UHFFFAOYSA-N
SMILES:
N#CC=C(c1ccccn1)c1ccccc1
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.248g/mol
Monoisotopic Mass:
206.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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