Name: Name:5-[(tert-butoxy)carbonyl]-2H,4H,5H,6H-pyrrolo[3,4-c]pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01EL2T
Rating: 90 (10 reviews)

5-[(tert-butoxy)carbonyl]-2H,4H,5H,6H-pyrrolo[3,4-c]pyrazole-4-carboxylic acid

CAS No.:

2137457-34-0

Catalog Number:

AG01EL2T

Molecular Formula:

C11H15N3O4

Molecular Weight:

253.2545

Catalog Number:

AG01EL2T

Chemical Name:

5-[(tert-butoxy)carbonyl]-2H,4H,5H,6H-pyrrolo[3,4-c]pyrazole-4-carboxylic acid

CAS Number:

2137457-34-0

Molecular Formula:

C11H15N3O4

Molecular Weight:

253.2545

MDL Number:

MFCD31453584

IUPAC Name:

5-[(2-methylpropan-2-yl)oxycarbonyl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-4-carboxylic acid

InChI:

InChI=1S/C11H15N3O4/c1-11(2,3)18-10(17)14-5-7-6(4-12-13-7)8(14)9(15)16/h4,8H,5H2,1-3H3,(H,12,13)(H,15,16)

InChI Key:

YPHGGCCRLAMYIS-UHFFFAOYSA-N

SMILES:

OC(=O)C1N(Cc2c1c[nH]n2)C(=O)OC(C)(C)C

Complexity:

366

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.258g/mol

Monoisotopic Mass:

253.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3