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2923-96-8 | Benzaldehyde, 4-fluoro-2-nitro-
CAS No: 2923-96-8 Catalog No: AG002XT2 MDL No:MFCD01666439
Product Description
Catalog Number:
AG002XT2
Chemical Name:
Benzaldehyde, 4-fluoro-2-nitro-
CAS Number:
2923-96-8
Molecular Formula:
C7H4FNO3
Molecular Weight:
169.1100
MDL Number:
MFCD01666439
IUPAC Name:
4-fluoro-2-nitrobenzaldehyde
InChI:
InChI=1S/C7H4FNO3/c8-6-2-1-5(4-10)7(3-6)9(11)12/h1-4H
InChI Key:
ORCGMGUNVGVHDN-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1[N+](=O)[O-])F
EC Number:
220-884-3
NSC Number:
96890
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:
1.4
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