meso-tert-Butyl hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate - CAS 250275-15-1
Catalog: |
BB018709 |
Product Name: |
meso-tert-Butyl hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate |
CAS: |
250275-15-1 |
Synonyms: |
tert-butyl (3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carboxylate |
IUPAC Name: | tert-butyl (3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carboxylate |
Description: | meso-tert-Butyl hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate (CAS# 250275-15-1) is a useful research chemical. |
Molecular Weight: | 212.29 |
Molecular Formula: | C11H20N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2CNCC2C1 |
InChI: | InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-8-4-12-5-9(8)7-13/h8-9,12H,4-7H2,1-3H3/t8-,9+ |
InChI Key: | FYUVLZRRIRGSTE-DTORHVGOSA-N |
Boiling Point: | 295.397 °C at 760 mmHg |
Purity: | 97+ % |
Density: | 1.076 g/cm3 |
Appearance: | Solid |
MDL: | MFCD04116224 |
LogP: | 1.33940 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.152477885 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 41.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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