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68788-46-5 | Benzaldehyde, 3-(hydroxyamino)-
CAS No: 68788-46-5 Catalog No: AG005O01 MDL No:
Product Description
Catalog Number:
AG005O01
Chemical Name:
Benzaldehyde, 3-(hydroxyamino)-
CAS Number:
68788-46-5
Molecular Formula:
C7H7NO2
Molecular Weight:
137.1360
IUPAC Name:
3-(hydroxyamino)benzaldehyde
InChI:
InChI=1S/C7H7NO2/c9-5-6-2-1-3-7(4-6)8-10/h1-5,8,10H
InChI Key:
GVDQQUJZMDSUNE-UHFFFAOYSA-N
SMILES:
ONc1cccc(c1)C=O
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
137.138g/mol
Monoisotopic Mass:
137.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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