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920270-03-7 | Benzoic acid, 4-[4-[2-(2-ethoxyethoxy)ethoxy]-5-methyl-2-thiazolyl]-
CAS No: 920270-03-7 Catalog No: AG0062MB MDL No:
Product Description
Catalog Number:
AG0062MB
Chemical Name:
Benzoic acid, 4-[4-[2-(2-ethoxyethoxy)ethoxy]-5-methyl-2-thiazolyl]-
CAS Number:
920270-03-7
Molecular Formula:
C17H21NO5S
Molecular Weight:
351.4173
IUPAC Name:
4-[4-[2-(2-ethoxyethoxy)ethoxy]-5-methyl-1,3-thiazol-2-yl]benzoic acid
InChI:
InChI=1S/C17H21NO5S/c1-3-21-8-9-22-10-11-23-15-12(2)24-16(18-15)13-4-6-14(7-5-13)17(19)20/h4-7H,3,8-11H2,1-2H3,(H,19,20)
InChI Key:
YCWLCBQMGNHROI-UHFFFAOYSA-N
SMILES:
CCOCCOCCOc1nc(sc1C)c1ccc(cc1)C(=O)O
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.114g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.417g/mol
Monoisotopic Mass:
351.114g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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