Cas no 530115-96-9 (tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate)
Tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate is a versatile intermediate in organic synthesis, particularly valuable for pharmaceutical and agrochemical applications. Its structure features a tert-butoxycarbonyl (Boc) protecting group, which enhances stability and facilitates selective deprotection under mild acidic conditions. The 4-cyano-4-methylpiperidine moiety provides a functional handle for further derivatization, enabling the introduction of diverse substituents. This compound is commonly employed in the synthesis of bioactive molecules due to its well-defined reactivity and compatibility with a range of reaction conditions. Its high purity and consistent performance make it a reliable choice for research and industrial-scale processes requiring precise molecular modifications.
530115-96-9 structure
Product Name:tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate
CAS No:530115-96-9
MF:C12H20N2O2
MW:224.299403190613
MDL:MFCD11849789
CID:823550
PubChem ID:46835621
Update Time:2025-06-07
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate
- 1-Boc-4-cyano-4-methylpiperidine
- 1-BOC-4-CYANO-4-METHYL-PIPERIDINE
- 4-Cyano-4-methyl-piperidine-1-carboxylic acid tert-butyl ester
- 1-Piperidinecarboxylic acid, 4-cyano-4-methyl-, 1,1-dimethylethyl ester
- 2-Methyl-2-propanyl 4-cyano-4-methyl-1-piperidinecarboxylate
- MFCD11849789
- SY023920
- VREJUXWEWOVHHU-UHFFFAOYSA-N
- Z1505694989
- DB-371980
- BCP21528
- AS-34635
- SCHEMBL1118226
- AKOS015841233
- 530115-96-9
- DTXSID00676502
- tert-Butyl4-cyano-4-methylpiperidine-1-carboxylate
- EN300-128226
- 1-Boc-4-cyano-4-methylpiperidine, AldrichCPR
- PB25438
- CS-0048222
-
- MDL： MFCD11849789
- Inchi： 1S/C12H20N2O2/c1-11(2,3)16-10(15)14-7-5-12(4,9-13)6-8-14/h5-8H2,1-4H3
- InChI Key： VREJUXWEWOVHHU-UHFFFAOYSA-N
- SMILES： O(C(C)(C)C)C(N1CCC(C#N)(C)CC1)=O
Computed Properties
- Exact Mass: 224.1526
- Monoisotopic Mass: 224.152477885g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 314
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 53.3?2
Experimental Properties
- Density: 1.05±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Slightly soluble (1.6 g/l) (25 o C),
- PSA: 53.33
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | FC10887-25g |
tert-butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 95% | 25g |
$1098 | 2023-09-07 | |
| Fluorochem | 211211-1g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 95% | 1g |
￡93.00 | 2022-03-01 | |
| Fluorochem | 211211-5g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 95% | 5g |
￡279.00 | 2022-03-01 | |
| Fluorochem | 211211-10g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 95% | 10g |
￡465.00 | 2022-03-01 | |
| Fluorochem | 211211-25g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 95% | 25g |
￡929.00 | 2022-03-01 | |
| ChemScence | CS-0048222-250mg |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | >97.0% | 250mg |
$40.0 | 2022-04-27 | |
| ChemScence | CS-0048222-1g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | >97.0% | 1g |
$80.0 | 2022-04-27 | |
| ChemScence | CS-0048222-5g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | >97.0% | 5g |
$240.0 | 2022-04-27 | |
| ChemScence | CS-0048222-10g |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | >97.0% | 10g |
$400.0 | 2022-04-27 | |
| TRC | B872343-100mg |
tert-butyl 4-cyano-4-methylpiperidine-1-carboxylate |
530115-96-9 | 100mg |
$ 70.00 | 2022-06-06 |
tert-Butyl 4-cyano-4-methylpiperidine-1-carboxylate Related Literature
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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