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130717-61-2 | 2-Thiazolecarboxylic acid, 4,5-bis(4-methoxyphenyl)-, ethyl ester
CAS No: 130717-61-2 Catalog No: AG000UUV MDL No:
Product Description
Catalog Number:
AG000UUV
Chemical Name:
2-Thiazolecarboxylic acid, 4,5-bis(4-methoxyphenyl)-, ethyl ester
CAS Number:
130717-61-2
Molecular Formula:
C20H19NO4S
Molecular Weight:
369.4342
IUPAC Name:
ethyl 4,5-bis(4-methoxyphenyl)-1,3-thiazole-2-carboxylate
InChI:
InChI=1S/C20H19NO4S/c1-4-25-20(22)19-21-17(13-5-9-15(23-2)10-6-13)18(26-19)14-7-11-16(24-3)12-8-14/h5-12H,4H2,1-3H3
InChI Key:
DHPDUTGFKMZVBI-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(c(s1)c1ccc(cc1)OC)c1ccc(cc1)OC
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.103g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.435g/mol
Monoisotopic Mass:
369.103g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
85.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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