Cas no 7153-22-2 (Ethyl 4-cyanobenzoate)

Ethyl 4-cyanobenzoate structure
Ethyl 4-cyanobenzoate structure
Product Name:Ethyl 4-cyanobenzoate
CAS No:7153-22-2
MF:C10H9NO2
MW:175.183962583542
MDL:MFCD00001824
CID:47255
PubChem ID:81589
Update Time:2025-04-18

Ethyl 4-cyanobenzoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4-cyanobenzoate
    • 4-cyano-benzoic acid ethyl ester
    • 4-ethoxycarbonylbenzonitrile
    • Benzoic acid,4-cyano-,ethyl ester
    • Ethyl 4-cyano-1-benzoate
    • ethyl 4-cyano-benzoate
    • ethyl p-cyanobenzoate
    • p-EtO2CC6H4CN
    • 4-Cyanobenzoic Acid Ethyl Ester
    • Benzoicacid, p-cyano-, ethyl ester (6CI,7CI,8CI)
    • 4-(Ethoxycarbonyl)benzonitrile
    • NSC 62689
    • Benzoic acid, 4-cyano-, ethyl ester
    • Benzoic acid, 4-cyano-,ethyl ester
    • JLSSWDFCYXSLQX-UHFFFAOYSA-N
    • ethyl-4-cyanobenzoate
    • p-cyano ethyl benzoate
    • 4-Cyanobenzoic acid, ethyl ester
    • EBD45230
    • NSC62689
    • STK002554
    • CE0073
    • SBB063744
    • A837235
    • 7153-22-2
    • NS00037243
    • Ethyl4-cyanobenzoate
    • F8881-1838
    • Q52773313
    • SY005785
    • InChI=1/C10H9NO2/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2H2,1H
    • EN300-1265958
    • DS-16734
    • NSC-62689
    • MFCD00001824
    • SCHEMBL1365179
    • DTXSID10221769
    • EINECS 230-500-6
    • Ethyl 4-cyanobenzoate, 99%
    • FT-0626080
    • AKOS005374533
    • AM20060933
    • E1167
    • W-104519
    • CS-W001928
    • BENZOIC ACID,4-CYANO,ETHYL ESTER
    • DTXCID90144260
    • DB-055547
    • MDL： MFCD00001824
    • Inchi： 1S/C10H9NO2/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2H2,1H3
    • InChI Key： JLSSWDFCYXSLQX-UHFFFAOYSA-N
    • SMILES： O(C(C1C=CC(C#N)=CC=1)=O)CC

Computed Properties

  • Exact Mass: 175.06300
  • Monoisotopic Mass: 175.063
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 220
  • 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: 2.5
  • Topological Polar Surface Area: 50.1

Experimental Properties

  • Color/Form: Solid
  • Density: 1.1999 (rough estimate)
  • Melting Point: 52.0 to 56.0 deg-C
  • Boiling Point: 140°C/11mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: 1.5060 (estimate)
  • PSA: 50.09000
  • LogP: 1.73498
  • λmax: 263(lit.)
  • Solubility: Not determined
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

Ethyl 4-cyanobenzoate Security Information

Ethyl 4-cyanobenzoate 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%

Ethyl 4-cyanobenzoate Pricemore >>

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