(1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylic acid tert-butyl ester oxalate
Properties
- Molecular formula
- C14H23NO6
- Molar mass
- 301.34 g/mol
- Exact mass
- 301.1525 Da
- logP
- 0.87Crippen estimate
- Polar surface area
- 112.9 Ų
- H-bond donors / acceptors
- 3 / 5
- Rotatable bonds
- 1
Identifiers
CAS number
907606-68-2SMILES
CC(C)(C)OC(=O)[C@H]1NC[C@@H]2CCC[C@@H]21.O=C(O)C(=O)OInChIKey
ZCTXDLWZMFBZEV-PUBMXKGKSA-NInChI
InChI=1S/C12H21NO2.C2H2O4/c1-12(2,3)15-11(14)10-9-6-4-5-8(9)7-13-10;3-1(4)2(5)6/h8-10,13H,4-7H2,1-3H3;(H,3,4)(H,5,6)/t8-,9-,10-;/m0./s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Cyclopenta[C]pyrrole-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester, (1S,3ar,6as)-, ethanedioate (1:1)