Name: Name:6-isopropyl-3-methylisoxazolo[5,4-b]pyridine-4-carboxylic acid
Brand: Angene
SKU: AG00J9FJ
Rating: 90 (10 reviews)

6-isopropyl-3-methylisoxazolo[5,4-b]pyridine-4-carboxylic acid

CAS No.:

923690-37-3

Catalog Number:

AG00J9FJ

Molecular Formula:

C11H12N2O3

Molecular Weight:

220.2246

Catalog Number:

AG00J9FJ

Chemical Name:

6-isopropyl-3-methylisoxazolo[5,4-b]pyridine-4-carboxylic acid

CAS Number:

923690-37-3

Molecular Formula:

C11H12N2O3

Molecular Weight:

220.2246

MDL Number:

MFCD08444312

IUPAC Name:

3-methyl-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid

InChI:

InChI=1S/C11H12N2O3/c1-5(2)8-4-7(11(14)15)9-6(3)13-16-10(9)12-8/h4-5H,1-3H3,(H,14,15)

InChI Key:

RILQHLKPPRZHAO-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(nc2c1c(C)no2)C(C)C

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.228g/mol

Monoisotopic Mass:

220.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1