Home Other Building Blocks 2-[(2-methoxy-2-oxoethyl)sulfanyl]acetic acid

2-[(2-methoxy-2-oxoethyl)sulfanyl]acetic acid

CAS No.:
91114-48-6
Catalog Number:
AG01A6ZU
Molecular Formula:
C5H8O4S
Molecular Weight:
164.1796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A6ZU
Chemical Name:
2-[(2-methoxy-2-oxoethyl)sulfanyl]acetic acid
CAS Number:
91114-48-6
Molecular Formula:
C5H8O4S
Molecular Weight:
164.1796
MDL Number:
MFCD11646668
IUPAC Name:
2-(2-methoxy-2-oxoethyl)sulfanylacetic acid
InChI:
InChI=1S/C5H8O4S/c1-9-5(8)3-10-2-4(6)7/h2-3H2,1H3,(H,6,7)
InChI Key:
YNPVYNMNQMSFNP-UHFFFAOYSA-N
SMILES:
COC(=O)CSCC(=O)O
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.014g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.175g/mol
Monoisotopic Mass:
164.014g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties