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1087-40-7 | 2-phenyl-N'-[(1E)-(pyridin-3-yl)methylidene]acetohydrazide
CAS No: 1087-40-7 Catalog No: AG00IWTW MDL No:MFCD00617305
Product Description
Catalog Number:
AG00IWTW
Chemical Name:
2-phenyl-N'-[(1E)-(pyridin-3-yl)methylidene]acetohydrazide
CAS Number:
1087-40-7
Molecular Formula:
C14H13N3O
Molecular Weight:
239.2725
MDL Number:
MFCD00617305
IUPAC Name:
2-phenyl-N-(pyridin-3-ylmethylideneamino)acetamide
InChI:
InChI=1S/C14H13N3O/c18-14(9-12-5-2-1-3-6-12)17-16-11-13-7-4-8-15-10-13/h1-8,10-11H,9H2,(H,17,18)
InChI Key:
SMUOPVMIAAVILN-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccccc1)N/N=C/c1cccnc1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.278g/mol
Monoisotopic Mass:
239.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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