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14683-79-5 | Benzaldehyde, 2-methyl-, oxime
CAS No: 14683-79-5 Catalog No: AG001EDI MDL No:
Product Description
Catalog Number:
AG001EDI
Chemical Name:
Benzaldehyde, 2-methyl-, oxime
CAS Number:
14683-79-5
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
IUPAC Name:
N-[(2-methylphenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C8H9NO/c1-7-4-2-3-5-8(7)6-9-10/h2-6,10H,1H3
InChI Key:
ARLLNMVPNCXCIM-UHFFFAOYSA-N
SMILES:
ON=Cc1ccccc1C
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Mechanism of methoxide ion substitution in the z and e isomers of o-methylbenzohydroximoyl halides. | The Journal of organic chemistry 20040416 |
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