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Home > Pyridines > 338414-02-1
338414-02-1 | (2E)-3-oxo-2-(2-phenylhydrazin-1-ylidene)-3-(pyridin-4-yl)propanal
CAS No: 338414-02-1 Catalog No: AG00IPIM MDL No:MFCD00975103
Product Description
Catalog Number:
AG00IPIM
Chemical Name:
(2E)-3-oxo-2-(2-phenylhydrazin-1-ylidene)-3-(pyridin-4-yl)propanal
CAS Number:
338414-02-1
Molecular Formula:
C14H11N3O2
Molecular Weight:
253.2560
MDL Number:
MFCD00975103
IUPAC Name:
3-hydroxy-2-phenyldiazenyl-1-pyridin-4-ylprop-2-en-1-one
InChI:
InChI=1S/C14H11N3O2/c18-10-13(14(19)11-6-8-15-9-7-11)17-16-12-4-2-1-3-5-12/h1-10,18H
InChI Key:
URQINECECVXAEZ-UHFFFAOYSA-N
SMILES:
O=C/C(=N\Nc1ccccc1)/C(=O)c1ccncc1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.261g/mol
Monoisotopic Mass:
253.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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