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850348-62-8 | 3-Thiophenesulfonamide,4-bromo-N-(2,2-dimethoxyethyl)-
CAS No: 850348-62-8 Catalog No: AG004PXY MDL No:
Product Description
Catalog Number:
AG004PXY
Chemical Name:
3-Thiophenesulfonamide,4-bromo-N-(2,2-dimethoxyethyl)-
CAS Number:
850348-62-8
Molecular Formula:
C8H12BrNO4S2
Molecular Weight:
330.2192
IUPAC Name:
4-bromo-N-(2,2-dimethoxyethyl)thiophene-3-sulfonamide
InChI:
InChI=1S/C8H12BrNO4S2/c1-13-8(14-2)3-10-16(11,12)7-5-15-4-6(7)9/h4-5,8,10H,3H2,1-2H3
InChI Key:
PZPJOCZMMUOPPO-UHFFFAOYSA-N
SMILES:
COC(CNS(=O)(=O)c1cscc1Br)OC
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.939g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.211g/mol
Monoisotopic Mass:
328.939g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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