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1137-96-8 | Benzenamine, N-(phenylmethylene)-, N-oxide
CAS No: 1137-96-8 Catalog No: AG0009DP MDL No:MFCD00013895
Product Description
Catalog Number:
AG0009DP
Chemical Name:
Benzenamine, N-(phenylmethylene)-, N-oxide
CAS Number:
1137-96-8
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
MDL Number:
MFCD00013895
IUPAC Name:
N,1-diphenylmethanimine oxide
InChI:
InChI=1S/C13H11NO/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-11H/b14-11-
InChI Key:
ZEAUJQWDPKRESH-KAMYIIQDSA-N
SMILES:
[O-][N+](=Cc1ccccc1)c1ccccc1
EC Number:
214-509-2
NSC Number:
102882
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Conformational preferences of methacrolein in Diels-Alder and 1,3-dipolar cycloaddition reactions. | The Journal of organic chemistry 20061222 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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