Home Carboxys 5-(3-acetylphenoxymethyl)-1,2-oxazole-3-carboxylic acid

5-(3-acetylphenoxymethyl)-1,2-oxazole-3-carboxylic acid

CAS No.:
1281554-27-5
Catalog Number:
AG01A46J
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A46J
Chemical Name:
5-(3-acetylphenoxymethyl)-1,2-oxazole-3-carboxylic acid
CAS Number:
1281554-27-5
MDL Number:
MFCD16385637
IUPAC Name:
5-[(3-acetylphenoxy)methyl]-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C13H11NO5/c1-8(15)9-3-2-4-10(5-9)18-7-11-6-12(13(16)17)14-19-11/h2-6H,7H2,1H3,(H,16,17)
InChI Key:
IKUJGPJFLBFNCF-UHFFFAOYSA-N
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.064g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.233g/mol
Monoisotopic Mass:
261.064g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties