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21789-40-2 | Benzaldehyde, 4-bromo-2,6-dimethyl-, oxime
CAS No: 21789-40-2 Catalog No: AG006Z9Z MDL No:
Product Description
Catalog Number:
AG006Z9Z
Chemical Name:
Benzaldehyde, 4-bromo-2,6-dimethyl-, oxime
CAS Number:
21789-40-2
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
IUPAC Name:
N-[(4-bromo-2,6-dimethylphenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C9H10BrNO/c1-6-3-8(10)4-7(2)9(6)5-11-12/h3-5,12H,1-2H3
InChI Key:
GIPGAJDBJBXPND-UHFFFAOYSA-N
SMILES:
ON=Cc1c(C)cc(cc1C)Br
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.089g/mol
Monoisotopic Mass:
226.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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