Cas no 2947-60-6 ((3-Methylphenyl)acetonitrile)

(3-Methylphenyl)acetonitrile is a versatile organic compound with the molecular formula C?H?N, featuring a phenyl ring substituted with a methyl group at the meta-position and an acetonitrile functional group. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Its nitrile group offers reactivity for further transformations, such as hydrolysis to carboxylic acids or reduction to primary amines. The methyl substitution enhances solubility and influences electronic properties, making it valuable for fine-tuning reaction pathways. High purity grades are available to ensure consistent performance in synthetic applications. Proper handling is advised due to its potential toxicity and irritant properties.
(3-Methylphenyl)acetonitrile structure
(3-Methylphenyl)acetonitrile structure
Product Name:(3-Methylphenyl)acetonitrile
CAS No:2947-60-6
MF:C9H9N
MW:131.174462080002
MDL:MFCD00001914
CID:43629
PubChem ID:87577906
Update Time:2025-11-02

(3-Methylphenyl)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-(3-Methylphenyl)acetonitrile
    • 3-Methylphenylacetonitrile
    • 3-Methylbenzyl cyanide~3-Methylphenylacetonitrile
    • m-Tolylacetonitrile
    • m-Xylyl Cyanide
    • (3-Methylphenyl)acetonitrile
    • 3-Methylbenzyl cyanide
    • 2-(m-methylphenyl)acetonitrile
    • 3-methyl-benzeneacetonitrile
    • meta-methylbenzyl cyanide
    • m-Methylbenzyl cyanide
    • m-methylphenylacetonitrile
    • M-Tolyacetonitrile
    • 2-(m-tolyl)acetonitrile
    • 3-Methylbenzylcyanide
    • Benzeneacetonitrile, 3-methyl-
    • 2-m-tolylacetonitrile
    • 2-(3-methylphenyl)ethanenitrile
    • WOJADIOTNFDWNQ-UHFFFAOYSA-N
    • 3-Tolylacetonitrile
    • 3-methyl benzylcyanide
    • 3-methyl-benzyl cyani
    • CS-W005445
    • X0046
    • NSC 20695
    • MFCD00001914
    • DTXSID30183673
    • VK65R23ZZK
    • SCHEMBL625612
    • NSC20695
    • Z285131450
    • 2947-60-6
    • 3-methyl-benzyl cyanide
    • BP-11282
    • FS-4421
    • 3-Methylbenzyl cyanide, 98%
    • SY046497
    • EN300-39607
    • A5495
    • AC-16936
    • (3-methylphenyl)-acetonitrile
    • NSC-20695
    • CK2045
    • FT-0628959
    • A819927
    • 3-Methylbenzeneacetonitrile
    • UNII-VK65R23ZZK
    • NS00028712
    • J-017536
    • A820305
    • AKOS000154017
    • EINECS 220-962-7
    • DB-047589
    • 1-methyl-3-cyanomethylbenzene
    • STL168033
    • 220-962-7
    • DTXCID70106164
    • MDL: MFCD00001914
    • Inchi: 1S/C9H9N/c1-8-3-2-4-9(7-8)5-6-10/h2-4,7H,5H2,1H3
    • InChI Key: WOJADIOTNFDWNQ-UHFFFAOYSA-N
    • SMILES: N#CCC1C=CC=C(C)C=1
    • BRN: 1099644

Computed Properties

  • Exact Mass: 131.07300
  • Monoisotopic Mass: 131.073
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 142
  • 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: 2.1
  • Topological Polar Surface Area: 23.8

Experimental Properties

  • Color/Form: Not available
  • Density: 1.002?g/mL?at 25?°C(lit.)
  • Melting Point: >230 °F
  • Boiling Point: 130°C/10mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: n20/D 1.52(lit.)
  • Water Partition Coefficient: Insoluble
  • PSA: 23.79000
  • LogP: 2.06108
  • Solubility: Insoluble in water

(3-Methylphenyl)acetonitrile Security Information

(3-Methylphenyl)acetonitrile Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    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%

(3-Methylphenyl)acetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Fluorochem
092558-1g
2-(3-Methylphenyl)acetonitrile
2947-60-6 95%
1g
£10.00 2022-02-28
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
M31600-25G
(3-Methylphenyl)acetonitrile
2947-60-6 98%
25G
¥739.49 2022-02-23
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
M837943-25g
(3-Methylphenyl)acetonitrile
2947-60-6 98 %
25g
¥322.00 2022-09-01
TRC
M288715-1g
(3-Methylphenyl)acetonitrile
2947-60-6
1g
$ 125.00 2022-06-04
TRC
M288715-10g
(3-Methylphenyl)acetonitrile
2947-60-6
10g
$ 160.00 2022-06-04
TRC
M288715-50g
(3-Methylphenyl)acetonitrile
2947-60-6
50g
$ 220.00 2022-06-04
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
M67530-5g
2-(3-Methylphenyl)acetonitrile
2947-60-6
5g
¥66.0 2021-09-04
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
M67530-100g
2-(3-Methylphenyl)acetonitrile
2947-60-6
100g
¥606.0 2021-09-04
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
M67530-25g
2-(3-Methylphenyl)acetonitrile
2947-60-6
25g
¥156.0 2021-09-04
eNovation Chemicals LLC
Y1191546-100g
3-Methylphenylacetonitrile
2947-60-6 98%
100g
$130 2024-07-20

(3-Methylphenyl)acetonitrile Production Method

(3-Methylphenyl)acetonitrile Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:2947-60-6)3-Methylbenzyl cyanide
Order Number:sfd17787
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:38
Price ($):discuss personally

(3-Methylphenyl)acetonitrile Related Literature

Additional information on (3-Methylphenyl)acetonitrile

Exploring the Properties and Applications of (3-Methylphenyl)acetonitrile (CAS No. 2947-60-6)

(3-Methylphenyl)acetonitrile, with the CAS number 2947-60-6, is an important organic compound widely used in chemical synthesis and pharmaceutical research. This aromatic nitrile is known for its versatile applications, particularly in the development of fine chemicals and intermediates. Its molecular structure, featuring a methylphenyl group attached to an acetonitrile moiety, makes it a valuable building block in organic chemistry.

The compound is often searched under terms like "(3-Methylphenyl)acetonitrile uses", "CAS 2947-60-6 properties", and "m-Tolylacetonitrile synthesis", reflecting its relevance in both academic and industrial settings. Researchers and manufacturers frequently inquire about its solubility, stability, and reactivity, which are critical for optimizing synthetic pathways.

One of the trending topics in organic chemistry is the development of sustainable synthetic methods. (3-Methylphenyl)acetonitrile plays a role in this context, as it can be used in green chemistry applications, such as catalytic processes that minimize waste. Its compatibility with biocatalysts and metal-free reactions aligns with the growing demand for eco-friendly chemical production.

In the pharmaceutical industry, (3-Methylphenyl)acetonitrile is a key intermediate for the synthesis of active pharmaceutical ingredients (APIs). Its derivatives are explored for potential therapeutic applications, including anti-inflammatory and antimicrobial agents. Recent studies have also investigated its role in drug discovery, particularly in the design of small-molecule inhibitors.

The compound's physical and chemical properties are well-documented, with a molecular weight of 131.17 g/mol and a boiling point of approximately 230°C. Its aromatic character and nitrile functionality contribute to its reactivity in nucleophilic substitution and condensation reactions. These traits make it a popular choice for organic synthesis and material science applications.

From an industrial perspective, (3-Methylphenyl)acetonitrile is valued for its role in producing agrochemicals, dyes, and flavors. Its derivatives are used in crop protection formulations and fragrance manufacturing, addressing the needs of diverse sectors. The compound's stability under various conditions ensures its suitability for large-scale production.

Safety and handling of (3-Methylphenyl)acetonitrile are frequently discussed topics. While it is not classified as a hazardous material, proper laboratory practices should be followed, including the use of personal protective equipment (PPE) and adequate ventilation. Researchers often search for "CAS 2947-60-6 safety data" to ensure compliance with regulatory standards.

In conclusion, (3-Methylphenyl)acetonitrile (CAS No. 2947-60-6) is a multifaceted compound with significant applications in pharmaceuticals, agrochemicals, and material science. Its role in green chemistry and drug discovery highlights its ongoing relevance in modern research. As industries continue to innovate, this compound remains a cornerstone in the development of advanced chemical solutions.

Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:2947-60-6)3-Methylbenzyl cyanide
sfd17787
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Email