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Home > Fluorides > 1805958-48-8
1805958-48-8 | Pyridine, 2-(difluoromethyl)-4-nitro-
CAS No: 1805958-48-8 Catalog No: AG00224R MDL No:MFCD25476574
Product Description
Catalog Number:
AG00224R
Chemical Name:
Pyridine, 2-(difluoromethyl)-4-nitro-
CAS Number:
1805958-48-8
Molecular Formula:
C6H4F2N2O2
Molecular Weight:
174.1050
MDL Number:
MFCD25476574
IUPAC Name:
2-(difluoromethyl)-4-nitropyridine
InChI:
InChI=1S/C6H4F2N2O2/c7-6(8)5-3-4(10(11)12)1-2-9-5/h1-3,6H
InChI Key:
JETSNICDZNBABK-UHFFFAOYSA-N
SMILES:
FC(c1nccc(c1)[N+](=O)[O-])F
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.024g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.107g/mol
Monoisotopic Mass:
174.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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