Home Carboxys Methyl tetrahydro-2H-thiopyran-4-carboxylate

Methyl tetrahydro-2H-thiopyran-4-carboxylate

CAS No.:
128094-82-6
Catalog Number:
AG000XSJ
Molecular Formula:
C7H12O2S
Molecular Weight:
160.2340
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$199
- +
5g
97%
1 week
United States
$523
- +
10g
97%
1 week
United States
$846
- +
25g
97%
1 week
United States
$1655
- +
50g
97%
1 week
United States
$2624
- +
Product Description
Catalog Number:
AG000XSJ
Chemical Name:
Methyl tetrahydro-2H-thiopyran-4-carboxylate
CAS Number:
128094-82-6
Molecular Formula:
C7H12O2S
Molecular Weight:
160.2340
MDL Number:
MFCD09879923
IUPAC Name:
methyl thiane-4-carboxylate
InChI:
InChI=1S/C7H12O2S/c1-9-7(8)6-2-4-10-5-3-6/h6H,2-5H2,1H3
InChI Key:
OCBOIQWPCVXVKT-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCSCC1
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.056g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.231g/mol
Monoisotopic Mass:
160.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties