(3aR,6aR)-1-Methyl-hexahydropyrrolo[3,4-b]pyrrole Dihydrochloride - CAS 1417789-76-4
Catalog: |
BB059642 |
Product Name: |
(3aR,6aR)-1-Methyl-hexahydropyrrolo[3,4-b]pyrrole Dihydrochloride |
CAS: |
1417789-76-4 |
Synonyms: |
(3aR,6aR)-1-Methyl-hexahydropyrrolo[3,4-b]pyrrole Dihydrochloride; (3aR,6aR)-1-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrole; dihydrochloride; DL-(3aS,6aS)-1-methyl-hexahydropyrrolo[3,4-b]pyrrole; cis-1-Methylhexahydropyrrolo[3,4-b]pyrrole Dihydrochloride; cis-Octahydro-1-methylpyrrolo[3,4-b]pyrrole dihydrochloride |
IUPAC Name: | (3aR,6aR)-1-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrroledihydrochloride |
Description: | (3aR,6aR)-1-Methyl-hexahydropyrrolo[3,4-b]pyrrole Dihydrochloride |
Molecular Weight: | 199.12 |
Molecular Formula: | C7H16Cl2N2 |
Canonical SMILES: | CN1CCC2C1CNC2.Cl.Cl |
InChI: | InChI=1S/C7H14N2.2ClH/c1-9-3-2-6-4-8-5-7(6)9/h6-8H,2-5H2,1H32*1H/t6-,7+/m1../s1 |
InChI Key: | RUMPYDQZJSJKTJ-VJBFUYBPSA-N |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.0690539 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.0690539 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 15.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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