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Home > Nitro Compounds > 937661-09-1
937661-09-1 | 2,4-dimethyl-3,5-dinitrobenzene-1-sulfonyl chloride
CAS No: 937661-09-1 Catalog No: AG01BDC4 MDL No:MFCD09036294
Product Description
Catalog Number:
AG01BDC4
Chemical Name:
2,4-dimethyl-3,5-dinitrobenzene-1-sulfonyl chloride
CAS Number:
937661-09-1
Molecular Formula:
C8H7ClN2O6S
Molecular Weight:
294.6690
MDL Number:
MFCD09036294
IUPAC Name:
2,4-dimethyl-3,5-dinitrobenzenesulfonyl chloride
InChI:
InChI=1S/C8H7ClN2O6S/c1-4-6(10(12)13)3-7(18(9,16)17)5(2)8(4)11(14)15/h3H,1-2H3
InChI Key:
TWOATHSLDFFDQE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(c(c(c1C)[N+](=O)[O-])C)S(=O)(=O)Cl
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.971g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.662g/mol
Monoisotopic Mass:
293.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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