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Home > Nitro Compounds > 1421602-28-9
1421602-28-9 | 2-nitrothiophene-3-sulfonyl chloride
CAS No: 1421602-28-9 Catalog No: AG01AHJT MDL No:MFCD22392247
Product Description
Catalog Number:
AG01AHJT
Chemical Name:
2-nitrothiophene-3-sulfonyl chloride
CAS Number:
1421602-28-9
Molecular Formula:
C4H2ClNO4S2
Molecular Weight:
227.6460
MDL Number:
MFCD22392247
IUPAC Name:
2-nitrothiophene-3-sulfonyl chloride
InChI:
InChI=1S/C4H2ClNO4S2/c5-12(9,10)3-1-2-11-4(3)6(7)8/h1-2H
InChI Key:
SUEQUOBMHCCRCH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1sccc1S(=O)(=O)Cl
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.911g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.633g/mol
Monoisotopic Mass:
226.911g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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