Ethyl Hexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxylate - CAS 132414-79-0
Catalog: |
BB007585 |
Product Name: |
Ethyl Hexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxylate |
CAS: |
132414-79-0 |
Synonyms: |
2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole-5-carboxylic acid ethyl ester; ethyl 2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole-5-carboxylate |
IUPAC Name: | ethyl 2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole-5-carboxylate |
Description: | Ethyl Hexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxylate (CAS# 132414-79-0 ) is a useful research chemical. |
Molecular Weight: | 184.24 |
Molecular Formula: | C9H16N2O2 |
Canonical SMILES: | CCOC(=O)N1CC2CCNC2C1 |
InChI: | InChI=1S/C9H16N2O2/c1-2-13-9(12)11-5-7-3-4-10-8(7)6-11/h7-8,10H,2-6H2,1H3 |
InChI Key: | SULDDMOQJXWUNO-UHFFFAOYSA-N |
Boiling Point: | 277 ℃ at 760 mmHg |
Density: | 1.122 g/cm3 |
Storage: | Sealed in dry, 2-8 ℃ |
LogP: | 0.97260 |
Publication Number | Title | Priority Date |
CA-2691782-A1 | Octahydro-pyrrolo[3,4-b]pyrrole n-oxides | 20070911 |
EP-2188288-A1 | Octahydro-pyrrolo[3,4-b]pyrrole n-oxides | 20070911 |
JP-2010539099-A | Octahydro-pyrrolo [3,4-B] pyrrole N-oxide | 20070911 |
JP-5665540-B2 | Octahydro-pyrrolo [3,4-B] pyrrole N-oxide | 20070911 |
RU-2486187-C2 | OCTAHYDRO-PYRROLO[3,4-b]PYRROL N-OXIDES | 20070911 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.121177757 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.121177757 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 41.6 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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