Name: Name:1-Ethyloxycarbonyl-5-boc-3-amino-4,6-dihydro-pyrrolo[3,4-c]pyrazole
Brand: Angene
SKU: AG00BZRU
Rating: 90 (10 reviews)

1-Ethyloxycarbonyl-5-boc-3-amino-4,6-dihydro-pyrrolo[3,4-c]pyrazole

CAS No.:

398495-65-3

Catalog Number:

AG00BZRU

Molecular Formula:

C13H20N4O4

Molecular Weight:

296.3223

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

250mg

97%

1 week

United States

$188

- +

97%

1 week

United States

$413

- +

Product Description

Catalog Number:

AG00BZRU

Chemical Name:

1-Ethyloxycarbonyl-5-boc-3-amino-4,6-dihydro-pyrrolo[3,4-c]pyrazole

CAS Number:

398495-65-3

Molecular Formula:

C13H20N4O4

Molecular Weight:

296.3223

MDL Number:

MFCD08061258

IUPAC Name:

5-O-tert-butyl 1-O-ethyl 3-amino-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate

InChI:

InChI=1S/C13H20N4O4/c1-5-20-12(19)17-9-7-16(6-8(9)10(14)15-17)11(18)21-13(2,3)4/h5-7H2,1-4H3,(H2,14,15)

InChI Key:

VUWAGENLXQIUJY-UHFFFAOYSA-N

SMILES:

CCOC(=O)n1nc(c2c1CN(C2)C(=O)OC(C)(C)C)N

Properties

Complexity:

423

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

296.148g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.327g/mol

Monoisotopic Mass:

296.148g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

99.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
5-tert-Butyl 1-ethyl 3-amino-1,4,5,6-tetra-hydro-pyrrolo-[3,4-c]pyrazole-1,5-dicarboxyl-ate.	Acta crystallographica. Section E, Structure reports online 20110501

Properties