Home Halogens methyl 4-chloro-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylate

methyl 4-chloro-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylate

CAS No.:
1183881-54-0
Catalog Number:
AG01B1MJ
Molecular Formula:
C8H10ClNO3S
Molecular Weight:
235.6879
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Product Description
Catalog Number:
AG01B1MJ
Chemical Name:
methyl 4-chloro-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylate
CAS Number:
1183881-54-0
Molecular Formula:
C8H10ClNO3S
Molecular Weight:
235.6879
MDL Number:
MFCD12157986
IUPAC Name:
methyl 4-chloro-2-propan-2-yloxy-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C8H10ClNO3S/c1-4(2)13-8-10-6(9)5(14-8)7(11)12-3/h4H,1-3H3
InChI Key:
PYBJQIXSZAXEER-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(nc1Cl)OC(C)C
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.007g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.682g/mol
Monoisotopic Mass:
235.007g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties