Home Other Building Blocks 3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione

3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione

CAS No.:
13031-76-0
Catalog Number:
AG000UAC
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$122
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG000UAC
Chemical Name:
3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione
CAS Number:
13031-76-0
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
MDL Number:
MFCD00154867
IUPAC Name:
1,1-dioxothiolan-3-ol
InChI:
InChI=1S/C4H8O3S/c5-4-1-2-8(6,7)3-4/h4-5H,1-3H2
InChI Key:
AMXKVIWWXBYXRS-UHFFFAOYSA-N
SMILES:
OC1CCS(=O)(=O)C1
NSC Number:
147314
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.019g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
136.165g/mol
Monoisotopic Mass:
136.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Literature
Title Journal
Determination of busulfan in human plasma using an ELISA format. Therapeutic drug monitoring 20090801
Properties