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136978-96-6 | Ethanone, 2-bromo-1-(4-chlorophenyl)-, oxime
CAS No: 136978-96-6 Catalog No: AG0012MB MDL No:
Product Description
Catalog Number:
AG0012MB
Chemical Name:
Ethanone, 2-bromo-1-(4-chlorophenyl)-, oxime
CAS Number:
136978-96-6
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
IUPAC Name:
N-[2-bromo-1-(4-chlorophenyl)ethylidene]hydroxylamine
InChI:
InChI=1S/C8H7BrClNO/c9-5-8(11-12)6-1-3-7(10)4-2-6/h1-4,12H,5H2
InChI Key:
UXUYADQBOMGCBR-UHFFFAOYSA-N
SMILES:
BrCC(=NO)c1ccc(cc1)Cl
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.504g/mol
Monoisotopic Mass:
246.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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