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266369-49-7

266369-49-7 | 4-(Thiazol-2-yl);benzoic acid

CAS No: 266369-49-7 Catalog No: AG007KYY MDL No:MFCD08275675

Product Description

Catalog Number:
AG007KYY
Chemical Name:
4-(Thiazol-2-yl);benzoic acid
CAS Number:
266369-49-7
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
MDL Number:
MFCD08275675
IUPAC Name:
4-(1,3-thiazol-2-yl)benzoic acid
InChI:
InChI=1S/C10H7NO2S/c12-10(13)8-3-1-7(2-4-8)9-11-5-6-14-9/h1-6H,(H,12,13)
InChI Key:
NCAPRAZCSUNRLM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1nccs1

Properties

Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.231g/mol
Monoisotopic Mass:
205.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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