Home Other Building Blocks 3-((4-(tert-butyl)thiazol-2-yl)methoxy)benzoic acid

3-((4-(tert-butyl)thiazol-2-yl)methoxy)benzoic acid

CAS No.:
179103-95-8
Catalog Number:
AG01DJ5Q
Molecular Formula:
C15H17NO3S
Molecular Weight:
291.3654
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Product Description
Catalog Number:
AG01DJ5Q
Chemical Name:
3-((4-(tert-butyl)thiazol-2-yl)methoxy)benzoic acid
CAS Number:
179103-95-8
Molecular Formula:
C15H17NO3S
Molecular Weight:
291.3654
MDL Number:
MFCD10001690
IUPAC Name:
3-[(4-tert-butyl-1,3-thiazol-2-yl)methoxy]benzoic acid
InChI:
InChI=1S/C15H17NO3S/c1-15(2,3)12-9-20-13(16-12)8-19-11-6-4-5-10(7-11)14(17)18/h4-7,9H,8H2,1-3H3,(H,17,18)
InChI Key:
GVPSPEDBRZFRFS-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)OCc1scc(n1)C(C)(C)C
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.093g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.365g/mol
Monoisotopic Mass:
291.093g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties