Cas no 13105-53-8 (Carbamic acid, butyl-, phenylmethyl ester)
Carbamic acid, butyl-, phenylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, butyl-, phenylmethyl ester
- benzyl N-butylcarbamate
- Benzyl butylcarbamate
- CS-0160335
- SB77436
- DTXSID40402963
- SCHEMBL1667805
- MFCD00158472
- 13105-53-8
- C72236
- AKOS024340201
- benzylbutylcarbamate
- DS-11146
- cbz-butylamine
-
- MDL: MFCD00158472
- Inchi: 1S/C12H17NO2/c1-2-3-9-13-12(14)15-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,13,14)
- InChI Key: VQJDBGSINGXXEB-UHFFFAOYSA-N
- SMILES: O(C(NCCCC)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 207.12601
- Monoisotopic Mass: 207.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 177
- 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: 2.7
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 38.33
Carbamic acid, butyl-, phenylmethyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-BQ989-1g |
Carbamic acid, butyl-, phenylmethyl ester |
13105-53-8 | 95+% | 1g |
1002.0CNY | 2021-07-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-BQ989-250mg |
Carbamic acid, butyl-, phenylmethyl ester |
13105-53-8 | 95+% | 250mg |
575CNY | 2021-05-08 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-BQ989-50mg |
Carbamic acid, butyl-, phenylmethyl ester |
13105-53-8 | 95+% | 50mg |
142.0CNY | 2021-07-10 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | B76820-5g |
Benzyl butylcarbamate |
13105-53-8 | 95% | 5g |
¥3346.0 | 2022-10-09 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | B76820-1g |
Benzyl butylcarbamate |
13105-53-8 | 95% | 1g |
¥597.0 | 2022-10-09 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | B76820-250mg |
Benzyl butylcarbamate |
13105-53-8 | 95% | 250mg |
¥299.0 | 2022-10-09 | |
| abcr | AB505490-250 mg |
Benzyl butylcarbamate; . |
13105-53-8 | 250MG |
€128.10 | 2023-04-18 | ||
| abcr | AB505490-1 g |
Benzyl butylcarbamate; . |
13105-53-8 | 1g |
€190.70 | 2023-04-18 | ||
| eNovation Chemicals LLC | D761159-1g |
Carbamic acid, butyl-, phenylmethyl ester |
13105-53-8 | 95% | 1g |
$110 | 2024-06-06 | |
| eNovation Chemicals LLC | D761159-5g |
Carbamic acid, butyl-, phenylmethyl ester |
13105-53-8 | 95% | 5g |
$300 | 2024-06-06 |
Carbamic acid, butyl-, phenylmethyl ester Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
Additional information on Carbamic acid, butyl-, phenylmethyl ester
Carbamic Acid, Butyl-, Phenylmethyl Ester (CAS No. 13105-53-8)
Carbamic acid, butyl-, phenylmethyl ester, also known by its CAS number 13105-53-8, is a versatile organic compound with significant applications in various industries. This compound is a derivative of carbamic acid, where the hydroxyl group is replaced by an ester group formed from phenylmethyl alcohol and butanol. Its molecular structure consists of a central carbamate group (-O-CO-NH-) attached to a phenylmethyl (benzyl) group and a butyl group, making it a valuable intermediate in the synthesis of advanced materials and pharmaceuticals.
The synthesis of carbamic acid, butyl-, phenylmethyl ester typically involves the reaction of carbamic acid derivatives with appropriate alcohols under controlled conditions. This process often employs catalytic agents to enhance reaction efficiency and selectivity. Recent studies have explored the use of green chemistry principles to optimize the synthesis pathway, reducing environmental impact while maintaining product quality.
In terms of physical properties, this compound exhibits a melting point of approximately 45°C and a boiling point around 280°C under standard atmospheric pressure. It is slightly soluble in water but highly soluble in organic solvents such as dichloromethane and ethyl acetate, which facilitates its use in various chemical processes.
Carbamic acid, butyl-, phenylmethyl ester is widely recognized for its role as an intermediate in the production of polyurethanes and other high-performance polymers. Its ability to undergo nucleophilic acyl substitution reactions makes it an ideal building block for constructing complex molecular architectures. Recent advancements in polymer science have leveraged this compound to develop lightweight, high-strength materials for aerospace and automotive industries.
Beyond polymer applications, this compound finds utility in the pharmaceutical sector as an intermediate in drug synthesis. Its unique reactivity allows for the formation of bioactive molecules with potential therapeutic applications in oncology and neurodegenerative diseases. Researchers have recently reported its use in the development of targeted drug delivery systems, enhancing efficacy while minimizing side effects.
In agricultural applications, carbamic acid, butyl-, phenylmethyl ester serves as a precursor for agrochemicals designed to improve crop yield and pest resistance. Its role in the synthesis of herbicides and insecticides has been extensively studied, with recent breakthroughs focusing on eco-friendly formulations that reduce environmental toxicity.
The demand for CAS No. 13105-53-8 continues to grow due to its adaptability across multiple industries. Ongoing research aims to explore new synthetic pathways and application areas, further solidifying its position as a key player in modern chemistry.
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