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7338-26-3 | 1,3-Benzenedisulfonyl dichloride, 4,6-dimethyl-
CAS No: 7338-26-3 Catalog No: AG005EJ7 MDL No:
Product Description
Catalog Number:
AG005EJ7
Chemical Name:
1,3-Benzenedisulfonyl dichloride, 4,6-dimethyl-
CAS Number:
7338-26-3
Molecular Formula:
C8H8Cl2O4S2
Molecular Weight:
303.1827
IUPAC Name:
4,6-dimethylbenzene-1,3-disulfonyl chloride
InChI:
InChI=1S/C8H8Cl2O4S2/c1-5-3-6(2)8(16(10,13)14)4-7(5)15(9,11)12/h3-4H,1-2H3
InChI Key:
RRCFMPZTPWMGJB-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(cc1S(=O)(=O)Cl)S(=O)(=O)Cl
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.924g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.168g/mol
Monoisotopic Mass:
301.924g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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