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14597-96-7

14597-96-7 | 3H-1,2,4-Dithiazole-3-thione, 5-(2-furanyl)-

CAS No: 14597-96-7 Catalog No: AG001DKS MDL No:

Product Description

Catalog Number:
AG001DKS
Chemical Name:
3H-1,2,4-Dithiazole-3-thione, 5-(2-furanyl)-
CAS Number:
14597-96-7
Molecular Formula:
C6H3NOS3
Molecular Weight:
201.2891
IUPAC Name:
5-(furan-2-yl)-1,2,4-dithiazole-3-thione
InChI:
InChI=1S/C6H3NOS3/c9-6-7-5(10-11-6)4-2-1-3-8-4/h1-3H
InChI Key:
AKTPTXSXHKTXJV-UHFFFAOYSA-N
SMILES:
S=c1ssc(n1)c1ccco1

Properties

Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.938g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.276g/mol
Monoisotopic Mass:
200.938g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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