Cas no 138113-08-3 (7-Methoxy-1-naphthylacetonitrile)
7-Methoxy-1-naphthylacetonitrile Chemical and Physical Properties
Names and Identifiers
-
- 7-Methoxy-1-naphthylacetonitrile
- 1-Cyanomethyl-7-methoxynaphthalene
- 2-(7-Methoxy-1-naphthyl)acetonitrile
- 7-Methoxy-1-naphthaleneacetinitrile
- (7-Methoxy-1-naphthyl)acetonitrile
- 2-(7-methoxynaphthalen-1-yl)acetonitrile
- 7-methoxy-1-Naphthaleneacetonitrile
- 7-Methoxy-1-naphthyl
- (7-methoxynaphthalen-1-yl)acetonitrile
- 7-Methoxy-1-naphthylmethylcyanide
- [ "" ]
- 1-Naphthaleneacetonitrile, 7-methoxy-
- 7-Methoxynaphthalene-1-acetonitrile
- KSC169Q5R
- PYJMGUQHJINLLD-UHFFFAOYSA-N
- 7-Meth
- SCHEMBL989652
- 1-Cyanomethyl-7-methoxynaphthalene;2-(7-Methoxy-1-naphthyl)acetonitrile;7-Methoxy-1-naphthaleneacetinitrile
- (7-methoxy-naphthalen-1-yl)-acetonitrile
- 138113-08-3
- AC-24009
- AM20090762
- A25610
- EN300-117143
- SY033192
- TS-02792
- (7-Methoxy-naphthalen-1-yl)acetonitrile
- FT-0651955
- (7-Methoxynaphth-1-yl)acetonitrile
- NS00077840
- BCP07368
- CS-0097958
- (7-Methoxy-naphth-1-yl)acetonitrile
- PALMITELAIDICACID
- AKOS006288808
- M2421
- Q-102532
- MFCD08704309
- DTXSID90460472
- 7-Methoxy-1-naphthaleneacetinitrile; 1-Cyanomethyl-7-methoxynaphthalene; 2-(7-Methoxy-1-naphthyl)acetonitrile;
- DB-001012
-
- MDL: MFCD08704309
- Inchi: 1S/C13H11NO/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12/h2-6,9H,7H2,1H3
- InChI Key: PYJMGUQHJINLLD-UHFFFAOYSA-N
- SMILES: O(C)C1C=CC2=CC=CC(CC#N)=C2C=1
Computed Properties
- Exact Mass: 197.08413
- Monoisotopic Mass: 197.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 255
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.8
- Topological Polar Surface Area: 33
Experimental Properties
- Color/Form: Powder
- Density: 1.135
- Melting Point: 82.0 to 85.0 deg-C
- Boiling Point: 374.3°C at 760 mmHg
- Flash Point: 157.7±14.8 °C
- Refractive Index: 1.609
- PSA: 33.02
- LogP: 2.91448
7-Methoxy-1-naphthylacetonitrile Security Information
-
Symbol:
- Prompt:dangerous
- Signal Word:Warning
- Hazard Statement: H301+H311+H331-H315-H319
- Warning Statement: P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
- Hazardous Material transportation number:UN 3439 6.1/PG III
- Safety Instruction: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- HazardClass:6.1
- PackingGroup:III
- Storage Condition:Store at room temperature
7-Methoxy-1-naphthylacetonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| YUN NAN XI LI SHENG WU JI SHU GU FEN Co., Ltd. | BBP80047-5mg |
7-Methoxy-1-naphthylacetonitrile |
138113-08-3 | 98.0% | 5mg |
¥300 | 2021-05-07 | |
| Alichem | A219001286-500mg |
7-Methoxynaphthalene-1-acetonitrile |
138113-08-3 | 98% | 500mg |
999.60 USD | 2021-06-15 | |
| Alichem | A219001286-1g |
7-Methoxynaphthalene-1-acetonitrile |
138113-08-3 | 98% | 1g |
1,718.70 USD | 2021-06-15 | |
| Fluorochem | 069155-1g |
7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 97% | 1g |
£17.00 | 2022-03-01 | |
| Fluorochem | 069155-5g |
7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 97% | 5g |
£55.00 | 2022-03-01 | |
| Fluorochem | 069155-10g |
7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 97% | 10g |
£87.00 | 2022-03-01 | |
| Chemenu | CM140923-10g |
(7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 95% | 10g |
$107 | 2021-08-05 | |
| Chemenu | CM140923-25g |
(7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 95% | 25g |
$192 | 2021-08-05 | |
| Chemenu | CM140923-100g |
(7-Methoxy-1-naphthyl)acetonitrile |
138113-08-3 | 95% | 100g |
$514 | 2021-08-05 | |
| TRC | M264725-25mg |
7-Methoxy-1-naphthylacetonitrile |
138113-08-3 | 25mg |
$ 148.00 | 2023-09-07 |
7-Methoxy-1-naphthylacetonitrile Suppliers
7-Methoxy-1-naphthylacetonitrile Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
Additional information on 7-Methoxy-1-naphthylacetonitrile
Professional Introduction to 7-Methoxy-1-naphthylacetonitrile (CAS No. 138113-08-3)
7-Methoxy-1-naphthylacetonitrile, identified by the Chemical Abstracts Service Number (CAS No.) 138113-08-3, is a specialized organic compound that has garnered significant attention in the field of pharmaceutical and chemical research. This compound, featuring a naphthylacetonitrile backbone with a methoxy substituent, exhibits unique structural and chemical properties that make it a valuable intermediate in synthetic chemistry. Its molecular structure, consisting of a fused naphthalene ring connected to an acetonitrile group with a methoxy functional group, imparts distinct reactivity and utility in various chemical transformations.
The significance of 7-Methoxy-1-naphthylacetonitrile lies in its role as a building block in the synthesis of more complex molecules. In recent years, advancements in medicinal chemistry have highlighted its potential as a precursor in the development of novel therapeutic agents. The presence of the nitrile group provides a site for further functionalization, enabling the creation of diverse pharmacophores. This flexibility has been exploited in the design of molecules targeting various biological pathways, including those relevant to neurological disorders and inflammatory conditions.
Recent studies have demonstrated the utility of 7-Methoxy-1-naphthylacetonitrile in the synthesis of bioactive compounds. For instance, researchers have utilized this intermediate to develop derivatives with enhanced binding affinity to specific protein targets. The methoxy group, in particular, plays a crucial role in modulating the electronic properties of the molecule, influencing its interactions with biological receptors. This has opened up new avenues for drug discovery, where subtle modifications can lead to significant improvements in pharmacological activity.
The chemical reactivity of 7-Methoxy-1-naphthylacetonitrile makes it an attractive candidate for cross-coupling reactions, such as Suzuki-Miyaura and Heck couplings, which are fundamental in constructing complex organic frameworks. These reactions allow for the introduction of additional functional groups at strategic positions within the molecule, enhancing its suitability for medicinal chemistry applications. Moreover, the compound's stability under various reaction conditions makes it a reliable choice for multi-step syntheses.
In addition to its pharmaceutical applications, 7-Methoxy-1-naphthylacetonitrile has found utility in materials science and agrochemical research. Its ability to undergo selective modifications has been leveraged in the development of advanced materials with tailored properties. For example, derivatives of this compound have been explored as components in organic light-emitting diodes (OLEDs) due to their electron-withdrawing characteristics and ability to form stable conjugated systems.
The synthesis of 7-Methoxy-1-naphthylacetonitrile typically involves multi-step processes that require precise control over reaction conditions. Modern synthetic methodologies have improved the efficiency and scalability of its production, making it more accessible for industrial applications. Catalytic processes, in particular, have enabled higher yields and reduced byproduct formation, aligning with green chemistry principles.
From a regulatory perspective, 7-Methoxy-1-naphthylacetonitrile is not classified as a hazardous or controlled substance under current international guidelines. This classification simplifies its handling and distribution, facilitating its use in research and industrial settings without unnecessary restrictions. However, adherence to standard laboratory safety protocols remains essential when working with any chemical intermediate.
The future prospects for 7-Methoxy-1-naphthylacetonitrile are promising, with ongoing research exploring its potential in emerging fields such as precision medicine and targeted therapy. The compound's versatility as an intermediate continues to drive innovation across multiple disciplines. As synthetic chemistry advances, new methods for functionalizing this molecule are expected to emerge, further expanding its applications.
In conclusion,7-Methoxy-1-naphthylacetonitrile (CAS No. 138113-08-3) is a versatile and valuable compound with broad utility in pharmaceuticals, materials science, and agrochemicals. Its unique structural features and reactivity make it an indispensable tool for researchers seeking to develop novel molecules with therapeutic potential. As scientific understanding evolves,this compound will undoubtedly continue to play a pivotal role in advancing chemical research and innovation.
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