Name: Name:5-[(4-Methyl-1h-pyrazol-1-yl)methyl]isoxazole-3-carboxylic acid
Brand: Angene
SKU: AG008VDS
Rating: 90 (10 reviews)

5-[(4-Methyl-1h-pyrazol-1-yl)methyl]isoxazole-3-carboxylic acid

CAS No.:

1170258-35-1

Catalog Number:

AG008VDS

Molecular Formula:

C9H9N3O3

Molecular Weight:

207.1861

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Catalog Number:

AG008VDS

Chemical Name:

5-[(4-Methyl-1h-pyrazol-1-yl)methyl]isoxazole-3-carboxylic acid

CAS Number:

1170258-35-1

Molecular Formula:

C9H9N3O3

Molecular Weight:

207.1861

MDL Number:

MFCD12027289

IUPAC Name:

5-[(4-methylpyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid

InChI:

InChI=1S/C9H9N3O3/c1-6-3-10-12(4-6)5-7-2-8(9(13)14)11-15-7/h2-4H,5H2,1H3,(H,13,14)

InChI Key:

OZACKUJOJQBLKW-UHFFFAOYSA-N

SMILES:

Cc1cnn(c1)Cc1onc(c1)C(=O)O

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

207.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

207.189g/mol

Monoisotopic Mass:

207.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5