(S)-N-BOC-(2-CHLOROPHENYL)GLYCINE
(S)-N-BOC-(2-CHLOROPHENYL)GLYCINE structure
|
Common Name | (S)-N-BOC-(2-CHLOROPHENYL)GLYCINE | ||
|---|---|---|---|---|
| CAS Number | 130013-83-1 | Molecular Weight | 170.20900 | |
| Density | 1.021 | Boiling Point | 277ºC | |
| Molecular Formula | C8H14N2O2 | Melting Point | 105-108ºC | |
| MSDS | N/A | Flash Point | 121ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Boc-L-Ala-nitrile |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.021 |
|---|---|
| Boiling Point | 277ºC |
| Melting Point | 105-108ºC |
| Molecular Formula | C8H14N2O2 |
| Molecular Weight | 170.20900 |
| Flash Point | 121ºC |
| Exact Mass | 170.10600 |
| PSA | 62.12000 |
| LogP | 1.81408 |
| InChIKey | RPKPFOKNXKRFTD-LURJTMIESA-N |
| SMILES | CC(C#N)NC(=O)OC(C)(C)C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2926909090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~95%
(S)-N-BOC-(2-CH... CAS#:130013-83-1 |
| Literature: Sureshbabu, Vommina V.; Naik, Shankar A.; Nagendra Synthetic Communications, 2009 , vol. 39, # 3 p. 395 - 406 |
|
~85%
(S)-N-BOC-(2-CH... CAS#:130013-83-1 |
| Literature: Zhu, Jia-Liang; Lee, Fa-Yen; Wu, Jen-Dar; Kuo, Chun-Wei; Shia, Kak-Shan Synlett, 2007 , # 8 p. 1317 - 1319 |
|
~%
(S)-N-BOC-(2-CH... CAS#:130013-83-1 |
| Literature: Journal of Organic Chemistry, , vol. 71, # 26 p. 9869 - 9872 |
|
~%
(S)-N-BOC-(2-CH... CAS#:130013-83-1 |
| Literature: Tetrahedron Letters, , vol. 48, # 8 p. 1465 - 1468 |
|
~%
(S)-N-BOC-(2-CH... CAS#:130013-83-1 |
| Literature: Tetrahedron Letters, , vol. 48, # 8 p. 1465 - 1468 |
![Carbamic acid, [(1R)-1-cyanoethyl]-, 1,1-dimethylethyl ester (9CI) structure](https://image.chemsrc.com/caspic/193/100927-09-1.png)
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Phenotypic growth assay for Mycobacterium tuberculosis grown for 4 days on DPPC, chol...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4649948
|
|
Name: Phenotypic growth assay for Mycobacterium tuberculosis grown for 3 days on 7H9, gluco...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4649949
|
|
Name: Antibacterial activity against Acinetobacter baumannii ATCC 19606 (CO-ADD:GN_034); MI...
Source: ChEMBL
Target: Acinetobacter baumannii
External Id: CHEMBL4296188
|
|
Name: Antibacterial activity against Pseudomonas aeruginosa ATCC 27853 (CO-ADD:GN_042); MIC...
Source: ChEMBL
Target: Pseudomonas aeruginosa
External Id: CHEMBL4296187
|
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Name: Antibacterial activity against Pseudomonas aeruginosa PAO397 [PAO1 d(mexAB-oprM) d(me...
Source: ChEMBL
Target: Pseudomonas aeruginosa
External Id: CHEMBL4296802
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Boc-Ala-Nitrile |
| N-tert-butyloxycarbonyl alanine nitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of Boc-L-Ala-nitrile? |
| A: Molecular formula of Boc-L-Ala-nitrile is C8H14N2O2. |
| Q: What is the boiling point of Boc-L-Ala-nitrile? |
| A: Boiling point of Boc-L-Ala-nitrile is 277ºC. |
| Q: What is the English name of Boc-L-Ala-nitrile? |
| A: The English name of Boc-L-Ala-nitrile is Boc-L-Ala-nitrile. |
| Q: What is the LogP of Boc-L-Ala-nitrile? |
| A: LogP of Boc-L-Ala-nitrile is 1.81408. |
| Q: What English synonyms does Boc-L-Ala-nitrile have? |
| A: English synonyms of Boc-L-Ala-nitrile: Boc-Ala-Nitrile, N-tert-butyloxycarbonyl alanine nitrile. |
| Q: What is the InChIKey of Boc-L-Ala-nitrile? |
| A: InChIKey of Boc-L-Ala-nitrile is RPKPFOKNXKRFTD-LURJTMIESA-N. |
| Q: What is the polar surface area (PSA) of Boc-L-Ala-nitrile? |
| A: Polar surface area (PSA) of Boc-L-Ala-nitrile is 62.12000. |
| Q: What is the melting point of Boc-L-Ala-nitrile? |
| A: Melting point of Boc-L-Ala-nitrile is 105-108ºC. |
| Q: What is the CAS number of Boc-L-Ala-nitrile? |
| A: CAS number of Boc-L-Ala-nitrile is 130013-83-1. |
| Q: What is the SMILES notation of Boc-L-Ala-nitrile? |
| A: SMILES notation of Boc-L-Ala-nitrile is CC(C#N)NC(=O)OC(C)(C)C. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |