Cas no 49763-64-6 (4-Cyanophenyl 4-pentylbenzoate)

4-Cyanophenyl 4-pentylbenzoate structure
49763-64-6 structure
Product Name:4-Cyanophenyl 4-pentylbenzoate
CAS No:49763-64-6
MF:C19H19NO2
MW:293.359665155411
MDL:MFCD00101500
CID:55770
PubChem ID:170811
Update Time:2025-04-18

4-Cyanophenyl 4-pentylbenzoate Chemical and Physical Properties

Names and Identifiers

    • 4-Cyanophenyl 4-pentylbenzoate
    • p-Cyanophenyl p-pentylbenzoate
    • (4-cyanophenyl) 4-pentylbenzoate
    • 4-cyanopheny 4-pentylbenzoate
    • EINECS 256-477-2
    • p'-cyanophenyl-p-n-pentylbenzoate
    • p-n-pentylbenzoic acid p'-cyanophenyl ester
    • 49763-64-6
    • FT-0704668
    • NS00031963
    • W-106007
    • F71339
    • 4-pentyl-benzoic acid 4-cyano-phenyl ester
    • DTXSID6068519
    • 4-(n-bentyl)benzoic acid-4'-cyanophenol ester
    • SCHEMBL4652053
    • 4'-Cyanophenyl 4-pentylbenzoate
    • AKOS015917694
    • Benzoic acid, 4-pentyl-, 4-cyanophenyl ester
    • 4-Cyanophenyl-4'-N-pentylbenzoate
    • MFCD00101500
    • 4-Cyanophenyl-4-n-pentylbenzoate
    • A827843
    • DTXCID2040735
    • WCCDNUMASFDPFO-UHFFFAOYSA-N
    • MDL: MFCD00101500
    • Inchi: 1S/C19H19NO2/c1-2-3-4-5-15-6-10-17(11-7-15)19(21)22-18-12-8-16(14-20)9-13-18/h6-13H,2-5H2,1H3
    • InChI Key: WCCDNUMASFDPFO-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C#N)=CC=1)C(C1C=CC(=CC=1)CCCCC)=O

Computed Properties

  • Exact Mass: 293.14200
  • Monoisotopic Mass: 293.141578849g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 7
  • Complexity: 382
  • 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: 3
  • XLogP3: 5.5
  • Topological Polar Surface Area: 50.1?2

Experimental Properties

  • PSA: 50.09000
  • LogP: 4.51018

4-Cyanophenyl 4-pentylbenzoate 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%

4-Cyanophenyl 4-pentylbenzoate Pricemore >>

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