tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate
![tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate Structure](https://image.chemsrc.com/caspic/163/68076-40-4.png)
tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate structure
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Common Name | tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate | ||
|---|---|---|---|---|
| CAS Number | 68076-40-4 | Molecular Weight | 241.33000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C12H23N3O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C12H23N3O2 |
|---|---|
| Molecular Weight | 241.33000 |
| Exact Mass | 241.17900 |
| PSA | 77.64000 |
| LogP | 2.38988 |
| InChIKey | YHWSTQMDXGCLEA-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)NCCCCNCCC#N |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~97%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: HUNTER-FLEMING LIMITED Patent: WO2005/116050 A1, 2005 ; Location in patent: Page/Page column 30 ; |
|
~70%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Gardner, Richard Andrew; Kinkade, Rebecca; Wang, Chaojie; Phanstiel IV, Otto Journal of Organic Chemistry, 2004 , vol. 69, # 10 p. 3530 - 3537 |
|
~%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Hirashima, Naohide; Minatani, Kazuhiro; Hattori, Yoshifumi; Ohwada, Tomohiko; Nakanishi, Mamoru Biological and Pharmaceutical Bulletin, 2007 , vol. 30, # 6 p. 1117 - 1122 |
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~%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Arasujo, M. Joso S. M. P.; Ragnarsson, Ulf; Trigo, M. Joaquina S. A. Amaral; Almeida, M. Lurdes S. Journal of Chemical Research, Miniprint, 1996 , # 8 p. 2143 - 2161 |
|
~%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Arasujo, M. Joso S. M. P.; Ragnarsson, Ulf; Trigo, M. Joaquina S. A. Amaral; Almeida, M. Lurdes S. Journal of Chemical Research, Miniprint, 1996 , # 8 p. 2143 - 2161 |
|
~%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Arasujo, M. Joso S. M. P.; Ragnarsson, Ulf; Trigo, M. Joaquina S. A. Amaral; Almeida, M. Lurdes S. Journal of Chemical Research, Miniprint, 1996 , # 8 p. 2143 - 2161 |
|
~%
tert-butyl N-[4... CAS#:68076-40-4 |
| Literature: Andruszkiewicz,R. et al. Polish Journal of Chemistry, 1978 , vol. 52, p. 1167 - 1172 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 1 | |
CAS#:68076-39-1This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the Chinese name of 68076-40-4? |
| A: Chinese name of 68076-40-4 is 68076-40-4. |
| Q: What is the SMILES notation of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: SMILES notation of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is CC(C)(C)OC(=O)NCCCCNCCC#N. |
| Q: What is the molecular weight of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: Molecular weight of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is 241.33000. |
| Q: What is the molecular formula of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: Molecular formula of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is C12H23N3O2. |
| Q: What are the downstream products of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: Related downstream products(CAS) of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate: 68076-39-1. |
| Q: What is the LogP of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: LogP of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is 2.38988. |
| Q: What are the upstream materials of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: Related upstream materials(CAS) of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate: 68076-36-8;107-13-1;2417-90-5;24424-99-5;62146-59-2;75178-87-9;1070-19-5. |
| Q: What is the InChIKey of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: InChIKey of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is YHWSTQMDXGCLEA-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: Polar surface area (PSA) of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is 77.64000. |
| Q: What is the CAS number of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate? |
| A: CAS number of tert-butyl N-[4-(2-cyanoethylamino)butyl]carbamate is 68076-40-4. |