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89522-30-5 | Propanedial, [(2,4,6-trichlorophenyl)hydrazono]-, dioxime
CAS No: 89522-30-5 Catalog No: AG00407U MDL No:
Product Description
Catalog Number:
AG00407U
Chemical Name:
Propanedial, [(2,4,6-trichlorophenyl)hydrazono]-, dioxime
CAS Number:
89522-30-5
Molecular Formula:
C9H7Cl3N4O2
Molecular Weight:
309.5365
IUPAC Name:
N-[3-hydroxyimino-2-[(2,4,6-trichlorophenyl)hydrazinylidene]propylidene]hydroxylamine
InChI:
InChI=1S/C9H7Cl3N4O2/c10-5-1-7(11)9(8(12)2-5)16-15-6(3-13-17)4-14-18/h1-4,16-18H
InChI Key:
PHHHPMXIOIWGFB-UHFFFAOYSA-N
SMILES:
ON=CC(=NNc1c(Cl)cc(cc1Cl)Cl)C=NO
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.963g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
309.531g/mol
Monoisotopic Mass:
307.963g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.1
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