Home Sulfos 3-(Methylsulfonyl)-1-propanol

3-(Methylsulfonyl)-1-propanol

CAS No.:
2058-49-3
Catalog Number:
AG002ADO
Molecular Formula:
C4H10O3S
Molecular Weight:
138.1854
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$30
- +
5g
97%
In Stock USA
United States
$100
- +
10g
97%
In Stock USA
United States
$160
- +
25g
97%
In Stock USA
United States
$320
- +
Product Description
Catalog Number:
AG002ADO
Chemical Name:
3-(Methylsulfonyl)-1-propanol
CAS Number:
2058-49-3
Molecular Formula:
C4H10O3S
Molecular Weight:
138.1854
MDL Number:
MFCD01696727
IUPAC Name:
3-methylsulfonylpropan-1-ol
InChI:
InChI=1S/C4H10O3S/c1-8(6,7)4-2-3-5/h5H,2-4H2,1H3
InChI Key:
XPXXXQZNUQAFQY-UHFFFAOYSA-N
SMILES:
OCCCS(=O)(=O)C
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.035g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.181g/mol
Monoisotopic Mass:
138.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Literature
Title Journal
Free fatty acid receptor 1 (FFA1/GPR40) agonists: mesylpropoxy appendage lowers lipophilicity and improves ADME properties. Journal of medicinal chemistry 20120726
Properties