Home Other Building Blocks ethyl 3-oxo-3-(1,3-thiazol-5-yl)propanoate

ethyl 3-oxo-3-(1,3-thiazol-5-yl)propanoate

CAS No.:
1356404-83-5
Catalog Number:
AG01DVWV
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
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Product Description
Catalog Number:
AG01DVWV
Chemical Name:
ethyl 3-oxo-3-(1,3-thiazol-5-yl)propanoate
CAS Number:
1356404-83-5
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
MDL Number:
MFCD23911056
IUPAC Name:
ethyl 3-oxo-3-(1,3-thiazol-5-yl)propanoate
InChI:
InChI=1S/C8H9NO3S/c1-2-12-8(11)3-6(10)7-4-9-5-13-7/h4-5H,2-3H2,1H3
InChI Key:
VNKSPYXTDAPDCL-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1scnc1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties