Name: Name:4-{[(tert-butoxy)carbonyl]amino}-1-methyl-1H-pyrazole-5-carboxylic acid
Brand: Angene
SKU: AG01BNQN
Rating: 90 (10 reviews)

4-{[(tert-butoxy)carbonyl]amino}-1-methyl-1H-pyrazole-5-carboxylic acid

CAS No.:

1506512-05-5

Catalog Number:

AG01BNQN

Molecular Formula:

C10H15N3O4

Molecular Weight:

241.2438

Catalog Number:

AG01BNQN

Chemical Name:

4-{[(tert-butoxy)carbonyl]amino}-1-methyl-1H-pyrazole-5-carboxylic acid

CAS Number:

1506512-05-5

Molecular Formula:

C10H15N3O4

Molecular Weight:

241.2438

MDL Number:

MFCD26516636

IUPAC Name:

2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H15N3O4/c1-10(2,3)17-9(16)12-6-5-11-13(4)7(6)8(14)15/h5H,1-4H3,(H,12,16)(H,14,15)

InChI Key:

NDAGCIJPZHOZPG-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)Nc1cnn(c1C(=O)O)C

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.247g/mol

Monoisotopic Mass:

241.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2