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138890-87-6 | 2-Thiophenesulfonamide, 3-(2,5,5-trimethyl-1,3-dioxan-2-yl)-
CAS No: 138890-87-6 Catalog No: AG0019S4 MDL No:MFCD23135557
Product Description
Catalog Number:
AG0019S4
Chemical Name:
2-Thiophenesulfonamide, 3-(2,5,5-trimethyl-1,3-dioxan-2-yl)-
CAS Number:
138890-87-6
Molecular Formula:
C11H17NO4S2
Molecular Weight:
291.3870
MDL Number:
MFCD23135557
IUPAC Name:
3-(2,5,5-trimethyl-1,3-dioxan-2-yl)thiophene-2-sulfonamide
InChI:
InChI=1S/C11H17NO4S2/c1-10(2)6-15-11(3,16-7-10)8-4-5-17-9(8)18(12,13)14/h4-5H,6-7H2,1-3H3,(H2,12,13,14)
InChI Key:
IWLQNMKACMFWDL-UHFFFAOYSA-N
SMILES:
CC1(OCC(CO1)(C)C)c1ccsc1S(=O)(=O)N
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.38g/mol
Monoisotopic Mass:
291.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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