Cas no 39718-07-5 (5-Methylisophthalonitrile)

5-Methylisophthalonitrile structure
5-Methylisophthalonitrile structure
Product Name:5-Methylisophthalonitrile
CAS No:39718-07-5
MF:C9H6N2
MW:142.157341480255
CID:89383
PubChem ID:2736100
Update Time:2025-04-18

5-Methylisophthalonitrile Chemical and Physical Properties

Names and Identifiers

    • 5-Methylisophthalonitrile
    • 3,5-Dicyanotoluene
    • 5-methylbenzene-1,3-dicarbonitrile
    • 5-methyl-1,3-benzenedicarbonitrile
    • 5-Methyl-isophthalonitril
    • 5-methyl-isophthalonitrile
    • 39718-07-5
    • SCHEMBL1004620
    • CS-0367103
    • FT-0620660
    • DTXSID80371129
    • A824706
    • DB-022046
    • MFCD00052016
    • G68320
    • MDL： MFCD00052016
    • Inchi： 1S/C9H6N2/c1-7-2-8(5-10)4-9(3-7)6-11/h2-4H,1H3
    • InChI Key： LYSGVAGOLJKEGK-UHFFFAOYSA-N
    • SMILES： N#CC1C=C(C#N)C=C(C)C=1
    • BRN： 1940447

Computed Properties

  • Exact Mass: 142.05300
  • Monoisotopic Mass: 142.053
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 389
  • 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
  • XLogP3: 4.6
  • Topological Polar Surface Area: 40.6

Experimental Properties

  • Color/Form: powder
  • Density: 1.12
  • Melting Point: 166-168°C
  • Boiling Point: 276.1°Cat760mmHg
  • Flash Point: 128.2°C
  • Refractive Index: 1.555
  • PSA: 47.58000
  • LogP: 1.73836
  • Solubility: Insoluble

5-Methylisophthalonitrile Security Information

  • Hazard Statement： Toxic
  • Hazardous Material transportation number：3276
  • Hazard Category Code： 22
  • Safety Instruction： S22-S36/37
  • Hazardous Material Identification： T
  • HazardClass：6.1
  • PackingGroup：III
  • Packing Group：III
  • Hazard Level：6.1
  • Risk Phrases：R22
  • Packing Group：III
  • Safety Term：6.1

5-Methylisophthalonitrile 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%

5-Methylisophthalonitrile Pricemore >>

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5-Methylisophthalonitrile Production Method

5-Methylisophthalonitrile Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:39718-07-5)5-Methylisophthalonitrile
Order Number:A824706
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:10
Price ($):328.0

5-Methylisophthalonitrile Related Literature

39718-07-5 (5-Methylisophthalonitrile) Related Products

Recommended suppliers
Amadis Chemical Company Limited
(CAS:39718-07-5)5-Methylisophthalonitrile
A824706
Purity:99%
Quantity:5g
Price ($):328.0
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