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Home > Nitro Compounds > 1693872-60-4
1693872-60-4 | (5-nitrothiophen-2-yl)methanesulfonyl chloride
CAS No: 1693872-60-4 Catalog No: AG01B3UJ MDL No:
Product Description
Catalog Number:
AG01B3UJ
Chemical Name:
(5-nitrothiophen-2-yl)methanesulfonyl chloride
CAS Number:
1693872-60-4
Molecular Formula:
C5H4ClNO4S2
Molecular Weight:
241.6726
IUPAC Name:
(5-nitrothiophen-2-yl)methanesulfonyl chloride
InChI:
InChI=1S/C5H4ClNO4S2/c6-13(10,11)3-4-1-2-5(12-4)7(8)9/h1-2H,3H2
InChI Key:
XSMLNICXGIHEEM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(s1)CS(=O)(=O)Cl
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.927g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.66g/mol
Monoisotopic Mass:
240.927g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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