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100220-48-2 | Ethanone, 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)-, oxime
CAS No: 100220-48-2 Catalog No: AG0001A4 MDL No:
Product Description
Catalog Number:
AG0001A4
Chemical Name:
Ethanone, 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)-, oxime
CAS Number:
100220-48-2
Molecular Formula:
C11H9Cl2N3O
Molecular Weight:
270.1147
IUPAC Name:
N-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethylidene]hydroxylamine
InChI:
InChI=1S/C11H9Cl2N3O/c12-8-1-2-9(10(13)5-8)11(15-17)6-16-4-3-14-7-16/h1-5,7,17H,6H2
InChI Key:
WDFDJSRQMAZXEJ-UHFFFAOYSA-N
SMILES:
ON=C(c1ccc(cc1Cl)Cl)Cn1cncc1
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.012g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.113g/mol
Monoisotopic Mass:
269.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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