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1129-37-9 | 4-Nitrobenzaldehyde oxime
CAS No: 1129-37-9 Catalog No: AG003LUZ MDL No:MFCD00007377
Product Description
Catalog Number:
AG003LUZ
Chemical Name:
4-Nitrobenzaldehyde oxime
CAS Number:
1129-37-9
Molecular Formula:
C7H6N2O3
Molecular Weight:
166.1341
MDL Number:
MFCD00007377
IUPAC Name:
(NE)-N-[(4-nitrophenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C7H6N2O3/c10-8-5-6-1-3-7(4-2-6)9(11)12/h1-5,10H/b8-5+
InChI Key:
WTLPAVBACRIHHC-VMPITWQZSA-N
SMILES:
O/N=C/c1ccc(cc1)[N+](=O)[O-]
EC Number:
214-445-5
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
166.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.136g/mol
Monoisotopic Mass:
166.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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