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75601-36-4 | Benzaldehyde, 3,5-dimethyl-, oxime
CAS No: 75601-36-4 Catalog No: AG005WFO MDL No:
Product Description
Catalog Number:
AG005WFO
Chemical Name:
Benzaldehyde, 3,5-dimethyl-, oxime
CAS Number:
75601-36-4
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
(NE)-N-[(3,5-dimethylphenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C9H11NO/c1-7-3-8(2)5-9(4-7)6-10-11/h3-6,11H,1-2H3/b10-6+
InChI Key:
IZVOVGWUSRNAMC-UXBLZVDNSA-N
SMILES:
ON=Cc1cc(C)cc(c1)C
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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