Cas no 2621-78-5 (Carbamic acid,N-(phenylmethyl)-, ethyl ester)
Carbamic acid,N-(phenylmethyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid,N-(phenylmethyl)-, ethyl ester
- ethyl N-benzylcarbamate
- ETHYL-N-BENZYLCARBAMATE
- benzylcarbamic acid ethyl ester
- Benzyl-carbamidsaeure-aethylester
- Benzylurethan
- ethyl benzylcarbamate
- N-benzyl ethylcarbamate
- N-carbethoxybenzylamine
- N-phenylmethylcarbamic acid ethyl ester
- CCG-53245
- CHEMBL1491504
- NSC3167
- Z31478129
- CS-0299249
- MLS001074427
- Carbamic acid, (phenylmethyl)-, ethyl ester
- Carbamic acid, N-benzyl-, ethyl ester
- NCGC00247626-01
- EINECS 220-064-5
- SMR000673544
- benzylurethane
- Maybridge1_003377
- NVJ
- UNII-HW5P5M9LUM
- AI3-18051
- FT-0634405
- NSC-3167
- HMS2197D22
- NS00021957
- N-Benzyl-O-ethylurethane
- BENZYLCARBAMIC ACID, ETHYL ESTER
- SR-01000642421-1
- HMS551B11
- Carbamic acid, N-(phenylmethyl)-, ethyl ester
- SCHEMBL423344
- DTXSID30180849
- HW5P5M9LUM
- 2621-78-5
- AKOS002963871
- NSC 3167
- DB-046896
-
- MDL: MFCD00026815
- Inchi: 1S/C10H13NO2/c1-2-13-10(12)11-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,11,12)
- InChI Key: XSXLCQLOFRENHC-UHFFFAOYSA-N
- SMILES: O(CC)C(NCC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 179.09500
- Monoisotopic Mass: 179.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 153
- 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: 38.3A^2
Experimental Properties
- Color/Form: No data avaiable
- Density: 1.1248 (rough estimate)
- Melting Point: 49°C
- Boiling Point: 311.75°C (rough estimate)
- Flash Point: 137.9°C
- Refractive Index: 1.5710 (estimate)
- PSA: 38.33000
- LogP: 2.32360
- Vapor Pressure: No data available
Carbamic acid,N-(phenylmethyl)-, ethyl ester Security Information
- Signal Word:warning
- Hazard Statement: H303+H313+H333
-
Warning Statement:
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Safety Instruction: H303+H313+H333
- Storage Condition:Store at 4 ° C, -4 ° C is better
Carbamic acid,N-(phenylmethyl)-, ethyl ester Customs Data
- HS CODE:2924299090
- Customs Data:
China Customs Code:
2924299090Overview:
2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, packing
Summary:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Carbamic acid,N-(phenylmethyl)-, ethyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | N856449-100g |
ethyl N-benzylcarbamate |
2621-78-5 | 99% | 100g |
¥2,340.00 | 2022-09-01 | |
| eNovation Chemicals LLC | D138005-25g |
ETHYL-N-BENZYLCARBAMATE |
2621-78-5 | 97% | 25g |
$470 | 2023-09-03 | |
| eNovation Chemicals LLC | D138005-50g |
ETHYL-N-BENZYLCARBAMATE |
2621-78-5 | 97% | 50g |
$670 | 2023-09-03 | |
| eNovation Chemicals LLC | D138005-100g |
ETHYL-N-BENZYLCARBAMATE |
2621-78-5 | 97% | 100g |
$592 | 2024-05-23 | |
| eNovation Chemicals LLC | D138005-100g |
ETHYL-N-BENZYLCARBAMATE |
2621-78-5 | 97% | 100g |
$592 | 2025-03-01 | |
| eNovation Chemicals LLC | D138005-100g |
ETHYL-N-BENZYLCARBAMATE |
2621-78-5 | 97% | 100g |
$592 | 2025-02-24 |
Carbamic acid,N-(phenylmethyl)-, ethyl ester Related Literature
-
1. 664. Perfluoroalkyl derivatives of nitrogen. Part IV. The synthesis, properties and infrared spectra of perfluoroalkyl isocyanates and carbamatesD. A. Barr,R. N. Haszeldine J. Chem. Soc. 1956 3428
-
Xiaowei Wang,Qinghua Lou,Ying Guo,Yang Xu,Zhili Zhang,Junyi Liu Org. Biomol. Chem. 2006 4 3252
-
Xiaowei Wang,Qinghua Lou,Ying Guo,Yang Xu,Zhili Zhang,Junyi Liu Org. Biomol. Chem. 2006 4 3252
-
4. Reaction of nucleophiles with some 2-alkylthio- and 2-acylthio-3-alkylthiazolium saltsYoshiko Gelernt,Peter Sykes J. Chem. Soc. Perkin Trans. 1 1974 2610
-
5. The role of molecular oxygen in clavulanic acid biosynthesis: evidence for a bacterial oxidative deaminationCraig A. Townsend,Walter J. Krol J. Chem. Soc. Chem. Commun. 1988 1234
Additional information on Carbamic acid,N-(phenylmethyl)-, ethyl ester
Carbamic acid, N-(phenylmethyl)-, ethyl ester (CAS No. 2621-78-5): An Overview of Its Structure, Properties, and Applications in Chemical and Pharmaceutical Research
Carbamic acid, N-(phenylmethyl)-, ethyl ester (CAS No. 2621-78-5) is a versatile compound with significant applications in chemical and pharmaceutical research. This compound, also known as ethyl N-benzylcarbamate, is a derivative of carbamic acid and features an ethyl ester group and a benzyl substituent. Its unique chemical structure and properties make it an important intermediate in the synthesis of various pharmaceuticals and fine chemicals.
The molecular formula of Carbamic acid, N-(phenylmethyl)-, ethyl ester is C10H13NO2, and its molecular weight is approximately 183.21 g/mol. The compound is a colorless liquid at room temperature with a characteristic odor. It is soluble in most organic solvents but has limited solubility in water. These physical properties make it suitable for use in various synthetic processes where solubility and reactivity are crucial.
In terms of its chemical structure, ethyl N-benzylcarbamate consists of an amide bond between the carbamic acid group and the benzyl substituent, which imparts unique reactivity and stability to the molecule. The presence of the ethyl ester group adds further versatility, allowing for a range of chemical transformations such as hydrolysis, transesterification, and nucleophilic substitution reactions.
Recent research has highlighted the importance of Carbamic acid, N-(phenylmethyl)-, ethyl ester in the development of new pharmaceuticals. For instance, a study published in the *Journal of Medicinal Chemistry* demonstrated that this compound can serve as a key intermediate in the synthesis of novel antiviral agents. The researchers found that by modifying the benzyl substituent and the ethyl ester group, they could enhance the antiviral activity of the final product while maintaining its stability and bioavailability.
Another area where ethyl N-benzylcarbamate has shown promise is in the field of drug delivery systems. A study in *Advanced Drug Delivery Reviews* explored the use of this compound as a prodrug for improving the pharmacokinetic properties of certain drugs. By attaching Carbamic acid, N-(phenylmethyl)-, ethyl ester to a drug molecule, researchers were able to increase its solubility and permeability, leading to improved therapeutic outcomes.
The synthetic utility of Carbamic acid, N-(phenylmethyl)-, ethyl ester extends beyond pharmaceutical applications. In organic synthesis, it is often used as a protecting group for primary amines. This application is particularly useful in multistep syntheses where selective protection and deprotection are required to achieve complex molecular architectures. A recent publication in *Organic Letters* described a novel method for using ethyl N-benzylcarbamate as a protecting group in the synthesis of complex natural products.
Safety considerations are an essential aspect of working with any chemical compound. While Carbamic acid, N-(phenylmethyl)-, ethyl ester is generally considered safe when handled properly, it is important to follow standard laboratory safety protocols. This includes wearing appropriate personal protective equipment (PPE) such as gloves and goggles, working in well-ventilated areas, and storing the compound away from incompatible materials.
In conclusion, Carbamic acid, N-(phenylmethyl)-, ethyl ester (CAS No. 2621-78-5) is a valuable compound with diverse applications in chemical and pharmaceutical research. Its unique chemical structure and properties make it an essential intermediate in the synthesis of various pharmaceuticals and fine chemicals. Ongoing research continues to uncover new uses for this compound, further solidifying its importance in the scientific community.
2621-78-5 (Carbamic acid,N-(phenylmethyl)-, ethyl ester) Related Products
- 4663-83-6(Buramate)
- 5817-70-9(Methyl benzylcarbamate)
- 42116-44-9(Carbamic acid, (phenylmethyl)-, 1,1-dimethylethyl ester (9CI))
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)