Home Carboxys methyl 4-ethyl-1,3-thiazole-5-carboxylate

methyl 4-ethyl-1,3-thiazole-5-carboxylate

CAS No.:
114670-86-9
Catalog Number:
AG01A1VM
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
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Product Description
Catalog Number:
AG01A1VM
Chemical Name:
methyl 4-ethyl-1,3-thiazole-5-carboxylate
CAS Number:
114670-86-9
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD22375196
IUPAC Name:
methyl 4-ethyl-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C7H9NO2S/c1-3-5-6(7(9)10-2)11-4-8-5/h4H,3H2,1-2H3
InChI Key:
ISKDUOKBLSORJU-UHFFFAOYSA-N
SMILES:
COC(=O)c1scnc1CC
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties