CC(C)(C)OC(=O)N1CC2CC(=O)CC2C1
CAS: 146231-54-1
Name: tert-butyl (3aS,6aR)-5-oxo-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
SMILES: CC(C)(C)OC(=O)N1CC2CC(=O)CC2C1

Molecular Processing

Molecular formula
C12H19NO3
Molecular weight
225.29
Exact mass
225.1365
XLogP
1.83
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
16
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
59.03

Supplementary Information

InChIKey: GGNDIMLSSMWKDR-DTORHVGOSA-N
Synonyme
146231-54-1CIS-TERT-BUTYL 5-OXOHEXAHYDROCYCLOPENTA[C]PYRROLE-2(1H)-CARBOXYLATEcis-tert-Butyl 5-oxohexahydrocyclopenta(c)pyrrole-2(1H)-carboxylateRefChem:577427853-429-8cis-5-Oxohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylic acid tert-butyl ester(3aR,6aS)-tert-butyl 5-oxohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylatetert-butyl cis-5-oxo-octahydrocyclopenta[c]pyrrole-2-carboxylateMFCD12198689tert-butyl (3aR,6aS)-5-oxohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylatetert-butyl cis-5-oxo-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylatetert-butyl (3aR,6aS)-5-oxo-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate1173245-17-4MFCD187829072-BOC-5-OXO-HEXAHYDROCYCLOPENTA[C]PYRROLEtert-butyl (3aR,6aS)-5-oxo-octahydrocyclopenta[c]pyrrole-2-carboxylateSCHEMBL372037SCHEMBL30988547GGNDIMLSSMWKDR-DTORHVGOSA-NWFA23154AKOS025290414CS-W005946DS-9038SY029166DB-100916cis-2-Boc-5-oxohexahydrocyclopenta[c]pyrroleE73284EN300-379485F330884(3aR,6aS)-tert-butyl 5-oxohexahydrocyclopenta[c]pyrrole-2 (1H)-carboxylate
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