Home Other Building Blocks 2-(Ethylthio)propanoic acid

2-(Ethylthio)propanoic acid

CAS No.:
20461-87-4
Catalog Number:
AG0029M0
Molecular Formula:
C5H10O2S
Molecular Weight:
134.1967
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG0029M0
Chemical Name:
2-(Ethylthio)propanoic acid
CAS Number:
20461-87-4
Molecular Formula:
C5H10O2S
Molecular Weight:
134.1967
MDL Number:
MFCD09864598
IUPAC Name:
2-ethylsulfanylpropanoic acid
InChI:
InChI=1S/C5H10O2S/c1-3-8-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)
InChI Key:
QSPCCDNHTPQDKL-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)SCC
Properties
Complexity:
82.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.04g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
134.193g/mol
Monoisotopic Mass:
134.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties