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853644-05-0 | Benzoyl chloride, 4-[(1-acetyl-2-oxopropylidene)hydrazino]-
CAS No: 853644-05-0 Catalog No: AG004L6X MDL No:
Product Description
Catalog Number:
AG004L6X
Chemical Name:
Benzoyl chloride, 4-[(1-acetyl-2-oxopropylidene)hydrazino]-
CAS Number:
853644-05-0
Molecular Formula:
C12H11ClN2O3
Molecular Weight:
266.6803
IUPAC Name:
4-[(2-hydroxy-4-oxopent-2-en-3-yl)diazenyl]benzoyl chloride
InChI:
InChI=1S/C12H11ClN2O3/c1-7(16)11(8(2)17)15-14-10-5-3-9(4-6-10)12(13)18/h3-6,16H,1-2H3
InChI Key:
GQLPAZAUNBCDHQ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)NN=C(C(=O)C)C(=O)C
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.681g/mol
Monoisotopic Mass:
266.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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