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Home > Nitro Compounds > 74518-94-8
74518-94-8 | (E)-4-CYANO-4'-NITROSTILBENE
CAS No: 74518-94-8 Catalog No: AG005JDZ MDL No:
Product Description
Catalog Number:
AG005JDZ
Chemical Name:
(E)-4-CYANO-4'-NITROSTILBENE
CAS Number:
74518-94-8
Molecular Formula:
C15H10N2O2
Molecular Weight:
250.2521
IUPAC Name:
4-[(E)-2-(4-nitrophenyl)ethenyl]benzonitrile
InChI:
InChI=1S/C15H10N2O2/c16-11-14-5-3-12(4-6-14)1-2-13-7-9-15(10-8-13)17(18)19/h1-10H/b2-1+
InChI Key:
AVUPZCWYUFGWKE-OWOJBTEDSA-N
SMILES:
N#Cc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
250.074g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.257g/mol
Monoisotopic Mass:
250.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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