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532-54-7 | 2-Oxo-2-phenylacetaldehyde oxime
CAS No: 532-54-7 Catalog No: AG003HHA MDL No:MFCD00002122
Product Description
Catalog Number:
AG003HHA
Chemical Name:
2-Oxo-2-phenylacetaldehyde oxime
CAS Number:
532-54-7
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD00002122
IUPAC Name:
(2E)-2-hydroxyimino-1-phenylethanone
InChI:
InChI=1S/C8H7NO2/c10-8(6-9-11)7-4-2-1-3-5-7/h1-6,11H/b9-6+
InChI Key:
MLNKXLRYCLKJSS-RMKNXTFCSA-N
SMILES:
O/N=C/C(=O)c1ccccc1
EC Number:
208-539-5
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Biotransformation of isonitrosoacetophenone (2-keto-2-phenyl-acetaldoxime) in tobacco cell suspensions. | Biotechnology letters 20120701 |
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