Cas no 6525-45-7 (Ethyl 2-cyanobenzoate)

Ethyl 2-cyanobenzoate structure
Ethyl 2-cyanobenzoate structure
Product Name:Ethyl 2-cyanobenzoate
CAS No:6525-45-7
MF:C10H9NO2
MW:175.183962583542
MDL:MFCD03423595
CID:520245
PubChem ID:243890
Update Time:2025-04-19

Ethyl 2-cyanobenzoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-cyanobenzoate
    • Benzoic acid, 2-cyano-,ethyl ester
    • 2-carbethoxybenzonitrile
    • 2-Cyan-benzoesaeure-aethylester
    • 2-cyano-benzoic acid ethyl ester
    • ethyl cyanobenzoate
    • ethyl o-cyanobenzoate
    • Phthalsaeure-aethylester-nitril
    • Benzoic acid, 2-cyano-, ethyl ester
    • Ethyl 2-cyanobenzoate #
    • 2-Cyanobenzoic acid ethyl ester
    • RQQAJOJDAZNFPF-UHFFFAOYSA-N
    • NSC54113
    • TD1357
    • SBB053709
    • AS06913
    • SY005786
    • ETHYL 2-CYANOBENZOATE 97
    • AC-28477
    • DTXSID50288098
    • 6525-45-7
    • EN300-102392
    • Ethyl-2-cyanobenzoate,97%
    • NSC-54113
    • Ethyl 2-cyanobenzoate, 97%
    • CS-W003061
    • AKOS015902649
    • SCHEMBL120324
    • DB-012989
    • FS-2693
    • MFCD03423595
    • ETHYL2-CYANOBENZOATE
    • Z1255416132
    • MDL： MFCD03423595
    • Inchi： 1S/C10H9NO2/c1-2-13-10(12)9-6-4-3-5-8(9)7-11/h3-6H,2H2,1H3
    • InChI Key： RQQAJOJDAZNFPF-UHFFFAOYSA-N
    • SMILES： O(CC)C(C1C=CC=CC=1C#N)=O

Computed Properties

  • Exact Mass: 175.06300
  • Monoisotopic Mass: 175.063328530g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 228
  • 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
  • Melting Point: 63-67?°C (lit.)
  • Flash Point: 143.4℃
  • PSA: 50.09000
  • LogP: 1.73498
  • Solubility: Not determined

Ethyl 2-cyanobenzoate Security Information

  • Signal Word：Warning
  • Hazard Statement： H302-H315-H319-H335
  • Warning Statement： P261-P305+P351+P338
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Storage Condition：Sealed in dry,Room Temperature

Ethyl 2-cyanobenzoate Pricemore >>

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Ethyl 2-cyanobenzoate Production Method

Ethyl 2-cyanobenzoate Related Literature

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