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35195-83-6

35195-83-6 | 2-methoxy-5-(1,3-thiazol-2-yl)benzoic acid

CAS No: 35195-83-6 Catalog No: AG007FIZ MDL No:

Product Description

Catalog Number:
AG007FIZ
Chemical Name:
2-methoxy-5-(1,3-thiazol-2-yl)benzoic acid
CAS Number:
35195-83-6
Molecular Formula:
C11H9NO3S
Molecular Weight:
235.2591
IUPAC Name:
2-methoxy-5-(1,3-thiazol-2-yl)benzoic acid
InChI:
InChI=1S/C11H9NO3S/c1-15-9-3-2-7(6-8(9)11(13)14)10-12-4-5-16-10/h2-6H,1H3,(H,13,14)
InChI Key:
OPMJDVBBTICBGD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)O)c1nccs1

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.257g/mol
Monoisotopic Mass:
235.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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