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219963-62-9 | 3-Bromo-2,5-dichloronitrobenzene
CAS No: 219963-62-9 Catalog No: AG01FERE MDL No:MFCD18379730
Product Description
Catalog Number:
AG01FERE
Chemical Name:
3-Bromo-2,5-dichloronitrobenzene
CAS Number:
219963-62-9
Molecular Formula:
C6H2BrCl2NO2
Molecular Weight:
270.8956
MDL Number:
MFCD18379730
IUPAC Name:
1-bromo-2,5-dichloro-3-nitrobenzene
InChI:
InChI=1S/C6H2BrCl2NO2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H
InChI Key:
XTTZFLRDPMATAY-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.865g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.891g/mol
Monoisotopic Mass:
268.865g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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