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27996-87-8 | 2-Fluoro-5-nitrobenzaldehyde
CAS No: 27996-87-8 Catalog No: AG003HAJ MDL No:MFCD00042298
Product Description
Catalog Number:
AG003HAJ
Chemical Name:
2-Fluoro-5-nitrobenzaldehyde
CAS Number:
27996-87-8
Molecular Formula:
C7H4FNO3
Molecular Weight:
169.1100
MDL Number:
MFCD00042298
IUPAC Name:
2-fluoro-5-nitrobenzaldehyde
InChI:
InChI=1S/C7H4FNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-4H
InChI Key:
VVXFDFQEIRGULC-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1F)[N+](=O)[O-]
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.018g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.111g/mol
Monoisotopic Mass:
169.018g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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