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15952-70-2 | Benzene, 1,3-dichloro-2,4-difluoro-5-nitro-
CAS No: 15952-70-2 Catalog No: AG001R5H MDL No:MFCD03094441
Product Description
Catalog Number:
AG001R5H
Chemical Name:
Benzene, 1,3-dichloro-2,4-difluoro-5-nitro-
CAS Number:
15952-70-2
Molecular Formula:
C6HCl2F2NO2
Molecular Weight:
227.9804
MDL Number:
MFCD03094441
IUPAC Name:
1,3-dichloro-2,4-difluoro-5-nitrobenzene
InChI:
InChI=1S/C6HCl2F2NO2/c7-2-1-3(11(12)13)6(10)4(8)5(2)9/h1H
InChI Key:
OWALCRQILZGQDH-UHFFFAOYSA-N
SMILES:
Clc1cc([N+](=O)[O-])c(c(c1F)Cl)F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.935g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.976g/mol
Monoisotopic Mass:
226.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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