Home Other Building Blocks Ethyl 3-oxo-3-thiazol-2-yl-propionate

Ethyl 3-oxo-3-thiazol-2-yl-propionate

CAS No.:
212621-63-1
Catalog Number:
AG00BEG2
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$314
- +
5g
95%
1 week
United States
$869
- +
Product Description
Catalog Number:
AG00BEG2
Chemical Name:
Ethyl 3-oxo-3-thiazol-2-yl-propionate
CAS Number:
212621-63-1
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
MDL Number:
MFCD04114372
IUPAC Name:
ethyl 3-oxo-3-(1,3-thiazol-2-yl)propanoate
InChI:
InChI=1S/C8H9NO3S/c1-2-12-7(11)5-6(10)8-9-3-4-13-8/h3-4H,2,5H2,1H3
InChI Key:
IYGKPDXKHOZVBQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1nccs1
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.224g/mol
Monoisotopic Mass:
199.03g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties