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Home > Aldehydes > 193693-95-7
193693-95-7 | 3-Hydroxy-5-nitrobenzaldehyde
CAS No: 193693-95-7 Catalog No: AG00AC58 MDL No:MFCD11870180
Product Description
Catalog Number:
AG00AC58
Chemical Name:
3-Hydroxy-5-nitrobenzaldehyde
CAS Number:
193693-95-7
Molecular Formula:
C7H5NO4
Molecular Weight:
167.1189
MDL Number:
MFCD11870180
IUPAC Name:
3-hydroxy-5-nitrobenzaldehyde
InChI:
InChI=1S/C7H5NO4/c9-4-5-1-6(8(11)12)3-7(10)2-5/h1-4,10H
InChI Key:
QAGPTXBGYDEOFQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(O)cc(c1)N(=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:
2
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