Home Other Building Blocks 2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetic acid

2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetic acid

CAS No.:
927973-30-6
Catalog Number:
AG019LHU
Molecular Formula:
C13H13NO3S
Molecular Weight:
263.3122
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Product Description
Catalog Number:
AG019LHU
Chemical Name:
2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetic acid
CAS Number:
927973-30-6
Molecular Formula:
C13H13NO3S
Molecular Weight:
263.3122
MDL Number:
MFCD06857880
IUPAC Name:
2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetic acid
InChI:
InChI=1S/C13H13NO3S/c1-2-17-11-5-3-9(4-6-11)13-14-10(8-18-13)7-12(15)16/h3-6,8H,2,7H2,1H3,(H,15,16)
InChI Key:
JPVXSDGSCKFBFK-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)c1scc(n1)CC(=O)O
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.062g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.311g/mol
Monoisotopic Mass:
263.062g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties