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835622-71-4 | 1,3,4-Thiadiazole-2-sulfonyl chloride, 5-(4-chloro-2-nitrophenyl)-
CAS No: 835622-71-4 Catalog No: AG004UOO MDL No:
Product Description
Catalog Number:
AG004UOO
Chemical Name:
1,3,4-Thiadiazole-2-sulfonyl chloride, 5-(4-chloro-2-nitrophenyl)-
CAS Number:
835622-71-4
Molecular Formula:
C8H3Cl2N3O4S2
Molecular Weight:
340.1631
IUPAC Name:
5-(4-chloro-2-nitrophenyl)-1,3,4-thiadiazole-2-sulfonyl chloride
InChI:
InChI=1S/C8H3Cl2N3O4S2/c9-4-1-2-5(6(3-4)13(14)15)7-11-12-8(18-7)19(10,16)17/h1-3H
InChI Key:
PQGUZLANAQQUAR-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)[N+](=O)[O-])c1nnc(s1)S(=O)(=O)Cl
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.894g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.149g/mol
Monoisotopic Mass:
338.894g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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