Home Carboxys 3-(2,2-dimethylpropyl)-6-ethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid

3-(2,2-dimethylpropyl)-6-ethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid

CAS No.:
1096901-74-4
Catalog Number:
AG01B8SK
Molecular Formula:
C14H18N2O3
Molecular Weight:
262.3043
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Product Description
Catalog Number:
AG01B8SK
Chemical Name:
3-(2,2-dimethylpropyl)-6-ethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
CAS Number:
1096901-74-4
Molecular Formula:
C14H18N2O3
Molecular Weight:
262.3043
MDL Number:
MFCD12458048
IUPAC Name:
3-(2,2-dimethylpropyl)-6-ethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
InChI:
InChI=1S/C14H18N2O3/c1-5-8-6-9(13(17)18)11-10(7-14(2,3)4)16-19-12(11)15-8/h6H,5,7H2,1-4H3,(H,17,18)
InChI Key:
TZVUDTSLBCIJHJ-UHFFFAOYSA-N
SMILES:
CCc1nc2onc(c2c(c1)C(=O)O)CC(C)(C)C
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.132g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.309g/mol
Monoisotopic Mass:
262.132g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties