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90151-04-5 | 4-Hydroxy-2-nitrobenzaldehyde
CAS No: 90151-04-5 Catalog No: AG006IDF MDL No:MFCD18397317
Product Description
Catalog Number:
AG006IDF
Chemical Name:
4-Hydroxy-2-nitrobenzaldehyde
CAS Number:
90151-04-5
Molecular Formula:
C7H5NO4
Molecular Weight:
167.1189
MDL Number:
MFCD18397317
IUPAC Name:
4-hydroxy-2-nitrobenzaldehyde
InChI:
InChI=1S/C7H5NO4/c9-4-5-1-2-6(10)3-7(5)8(11)12/h1-4,10H
InChI Key:
PTVFUHTYJLKEDZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1[N+](=O)[O-])O
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.12g/mol
Monoisotopic Mass:
167.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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