Name: Name:3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid
Brand: Angene
SKU: AG00AD0Y
Rating: 90 (10 reviews)

3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid

CAS No.:

154780-52-6

Catalog Number:

AG00AD0Y

Molecular Formula:

C9H7NO4

Molecular Weight:

193.1562

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United States

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Catalog Number:

AG00AD0Y

Chemical Name:

3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid

CAS Number:

154780-52-6

Molecular Formula:

C9H7NO4

Molecular Weight:

193.1562

MDL Number:

MFCD09759336

IUPAC Name:

3-methyl-2-oxo-1,3-benzoxazole-5-carboxylic acid

InChI:

InChI=1S/C9H7NO4/c1-10-6-4-5(8(11)12)2-3-7(6)14-9(10)13/h2-4H,1H3,(H,11,12)

InChI Key:

LCLAZLIVBFONSJ-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)n(C)c(=O)o2

Complexity:

278

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.158g/mol

Monoisotopic Mass:

193.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8