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26579-86-2 | Benzenesulfonamide, N-1,3-dithietan-2-ylidene-
CAS No: 26579-86-2 Catalog No: AG002TRZ MDL No:
Product Description
Catalog Number:
AG002TRZ
Chemical Name:
Benzenesulfonamide, N-1,3-dithietan-2-ylidene-
CAS Number:
26579-86-2
Molecular Formula:
C8H7NO2S3
Molecular Weight:
245.3417
IUPAC Name:
N-(1,3-dithietan-2-ylidene)benzenesulfonamide
InChI:
InChI=1S/C8H7NO2S3/c10-14(11,9-8-12-6-13-8)7-4-2-1-3-5-7/h1-5H,6H2
InChI Key:
GDTOZQYEWZYORD-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)N=C1SCS1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.964g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.329g/mol
Monoisotopic Mass:
244.964g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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