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Home > Fluorides > 1235492-43-9
1235492-43-9 | Benzene, 1,2-difluoro-3-methoxy-5-nitro-
CAS No: 1235492-43-9 Catalog No: AG000KRR MDL No:MFCD28348447
Product Description
Catalog Number:
AG000KRR
Chemical Name:
Benzene, 1,2-difluoro-3-methoxy-5-nitro-
CAS Number:
1235492-43-9
Molecular Formula:
C7H5F2NO3
Molecular Weight:
189.1163
MDL Number:
MFCD28348447
IUPAC Name:
1,2-difluoro-3-methoxy-5-nitrobenzene
InChI:
InChI=1S/C7H5F2NO3/c1-13-6-3-4(10(11)12)2-5(8)7(6)9/h2-3H,1H3
InChI Key:
VLYKDOPLRIZFCY-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1F)F)[N+](=O)[O-]
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.118g/mol
Monoisotopic Mass:
189.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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