5-tert-butyl 1-ethyl 3-amino-6,6-dimethylpyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate
Basic information
- CAS
718632-47-4- Standard SMILES
CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2- InChIKey
IJRZSSYHHCGXMC-UHFFFAOYSA-N- Molecular formula
- C15H24N4O4
- Average molar mass
- 324.38 g/mol
- Monoisotopic mass
- 324.17975526
Names & identifiers
- Preferred name
- 5-tert-butyl 1-ethyl 3-amino-6,6-dimethylpyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate
- IUPAC
- 5-O-tert-butyl 1-O-ethyl 3-amino-6,6-dimethyl-4H-pyrrolo[3,4-d]pyrazole-1,5-dicarboxylate
- English name
- 5-tert-butyl 1-ethyl 3-amino-6,6-dimethylpyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate
- Molecular formula
- C15H24N4O4
- Molecular weight
- 324.38
Names & synonyms
718632-47-45-tert-butyl 1-ethyl 3-amino-6,6-dimethylpyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate5-(tert-butyl) 1-ethyl 3-amino-6,6-dimethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate5-O-tert-butyl 1-O-ethyl 3-amino-6,6-dimethyl-4H-pyrrolo[3,4-c]pyrazole-1,5-dicarboxylate5-tert-Butyl 1-ethyl 3-amino-6,6-dimethylpyrrolo-[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylateO5-tert-butyl O1-ethyl 3-amino-6,6-dimethyl-4H-pyrrolo[3,4-c]pyrazole-1,5-dicarboxylate5-tert-Butyl 1-ethyl 3-amino-6,6-dimethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylateMFCD22376574SCHEMBL596325DTXSID50722548IJRZSSYHHCGXMC-UHFFFAOYSA-NCS-M2485
Show more names
5-tert-butyl 1-ethyl 3-imino-6,6-dimethyl-2,3-dihydropyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate3-Amino-4,6-dihydro-6,6-dimethyl-pyrrolo[3,4-c]pyrazole-1,5-dicarboxylic acid 5-(1,1-dimethylethyl) 1-ethyl esterPyrrolo[3,4-c]pyrazole-1,5-dicarboxylic acid, 3-aMino-4,6-dihydro-6,6-diMethyl-, 5-(1,1-diMethylethyl) 1-ethyl ester
AKOS027420907s11036CS-13435DB-124071F7897185-Tert-Butyl 1-Ethyl 3-Amino-66-Dimethylpyrrolo[34-C]Pyrazole-15(4H6H)-Dicarboxylate5-tert-butyl1-ethyl3-amino-6,6-dimethylpyrrolo[3,4-c]pyrazole-1,5(4H,6H)-dicarboxylate
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 99.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 488
Physicochemical properties
- storage temp.
- 2 · 2-8°C(protect from light)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Related reactions
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Compound notes
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