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74663-99-3 | Benzaldehyde, 4-nitroso-
CAS No: 74663-99-3 Catalog No: AG008PF8 MDL No:
Product Description
Catalog Number:
AG008PF8
Chemical Name:
Benzaldehyde, 4-nitroso-
CAS Number:
74663-99-3
Molecular Formula:
C7H5NO2
Molecular Weight:
135.1201
IUPAC Name:
4-nitrosobenzaldehyde
InChI:
InChI=1S/C7H5NO2/c9-5-6-1-3-7(8-10)4-2-6/h1-5H
InChI Key:
JITMZUMTIBUTHH-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N=O
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.032g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.122g/mol
Monoisotopic Mass:
135.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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