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144240-75-5 | Benzaldehyde, 2,3-dihydroxy-4-nitro-
CAS No: 144240-75-5 Catalog No: AG001J60 MDL No:
Product Description
Catalog Number:
AG001J60
Chemical Name:
Benzaldehyde, 2,3-dihydroxy-4-nitro-
CAS Number:
144240-75-5
Molecular Formula:
C7H5NO5
Molecular Weight:
183.1183
IUPAC Name:
2,3-dihydroxy-4-nitrobenzaldehyde
InChI:
InChI=1S/C7H5NO5/c9-3-4-1-2-5(8(12)13)7(11)6(4)10/h1-3,10-11H
InChI Key:
JDACVGMXKJWJKK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1O)O)[N+](=O)[O-]
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.119g/mol
Monoisotopic Mass:
183.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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