Cas no 2680816-33-3 (tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate)
Tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate is a specialized bicyclic compound featuring a cyano group and a tert-butoxycarbonyl (Boc) protecting group. Its rigid decahydrocycloheptacpyrrole scaffold provides structural stability, while the cyano moiety enhances reactivity for further functionalization. The Boc group offers selective deprotection under mild acidic conditions, making it valuable in multi-step synthetic routes, particularly in pharmaceutical intermediates or peptide chemistry. This compound’s well-defined stereochemistry and functional group compatibility make it a versatile building block for constructing complex heterocycles or constrained analogs. Its stability under typical reaction conditions ensures reliable performance in diverse synthetic applications.
2680816-33-3 structure
Product Name:tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate
CAS No:2680816-33-3
MF:C15H24N2O2
MW:264.363264083862
CID:5650274
PubChem ID:165915808
Update Time:2025-10-29
tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 2680816-33-3
- EN300-28281794
- tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate
- tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate
-
- Inchi： 1S/C15H24N2O2/c1-14(2,3)19-13(18)17-9-12-7-5-4-6-8-15(12,10-16)11-17/h12H,4-9,11H2,1-3H3
- InChI Key： ZBXRTYBPYWZQCK-UHFFFAOYSA-N
- SMILES： O(C(C)(C)C)C(N1CC2CCCCCC2(C#N)C1)=O
Computed Properties
- Exact Mass: 264.183778013g/mol
- Monoisotopic Mass: 264.183778013g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 404
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 53.3?2
tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-28281794-0.05g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 0.05g |
$924.0 | 2025-03-19 | |
| Enamine | EN300-28281794-0.1g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 0.1g |
$968.0 | 2025-03-19 | |
| Enamine | EN300-28281794-0.25g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 0.25g |
$1012.0 | 2025-03-19 | |
| Enamine | EN300-28281794-0.5g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 0.5g |
$1056.0 | 2025-03-19 | |
| Enamine | EN300-28281794-1.0g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 1.0g |
$1100.0 | 2025-03-19 | |
| Enamine | EN300-28281794-2.5g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 2.5g |
$2155.0 | 2025-03-19 | |
| Enamine | EN300-28281794-5.0g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 5.0g |
$3189.0 | 2025-03-19 | |
| Enamine | EN300-28281794-10.0g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 95.0% | 10.0g |
$4729.0 | 2025-03-19 | |
| Enamine | EN300-28281794-1g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 1g |
$1100.0 | 2023-09-09 | ||
| Enamine | EN300-28281794-5g |
tert-butyl 3a-cyano-decahydrocyclohepta[c]pyrrole-2-carboxylate |
2680816-33-3 | 5g |
$3189.0 | 2023-09-09 |
tert-butyl 3a-cyano-decahydrocycloheptacpyrrole-2-carboxylate Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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