Name: Name:5-amino-1-tert-butyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01AD9I
Rating: 90 (10 reviews)

5-amino-1-tert-butyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1545779-06-3

Catalog Number:

AG01AD9I

Molecular Formula:

C8H13N3O2

Molecular Weight:

183.2077

Catalog Number:

AG01AD9I

Chemical Name:

5-amino-1-tert-butyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1545779-06-3

Molecular Formula:

C8H13N3O2

Molecular Weight:

183.2077

MDL Number:

MFCD26025357

IUPAC Name:

5-amino-1-tert-butylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C8H13N3O2/c1-8(2,3)11-6(9)5(4-10-11)7(12)13/h4H,9H2,1-3H3,(H,12,13)

InChI Key:

JHRWOZRHVYZOBZ-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnn(c1N)C(C)(C)C

Complexity:

212

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

183.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

183.211g/mol

Monoisotopic Mass:

183.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9