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135923-17-0 | 6-HYDROXY-5,6-DIMETHYL-1,3-THIAZINANE-2-THIONE
CAS No: 135923-17-0 Catalog No: AG007N5D MDL No:MFCD20667043
Product Description
Catalog Number:
AG007N5D
Chemical Name:
6-HYDROXY-5,6-DIMETHYL-1,3-THIAZINANE-2-THIONE
CAS Number:
135923-17-0
Molecular Formula:
C6H11NOS2
Molecular Weight:
177.2876
MDL Number:
MFCD20667043
IUPAC Name:
6-hydroxy-5,6-dimethyl-1,3-thiazinane-2-thione
InChI:
InChI=1S/C6H11NOS2/c1-4-3-7-5(9)10-6(4,2)8/h4,8H,3H2,1-2H3,(H,7,9)
InChI Key:
USILQBMQOVNCRS-UHFFFAOYSA-N
SMILES:
CC1(O)SC(=S)NCC1C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.028g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.28g/mol
Monoisotopic Mass:
177.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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