Cas no 6914-79-0 (1-Cyanocyclopropanecarboxylic acid)

1-Cyanocyclopropanecarboxylic acid structure
6914-79-0 structure
Product Name:1-Cyanocyclopropanecarboxylic acid
CAS No:6914-79-0
MF:C5H5NO2
MW:111.098701238632
MDL:MFCD00190651
CID:47069
PubChem ID:2733259
Update Time:2025-04-18

1-Cyanocyclopropanecarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-Cyanocyclopropanecarboxylic acid
    • 1-Cyano-1-cyclopropanecarboxylic acid
    • 1-cyanocyclopropane-1-carboxylic acid
    • C5H5NO2
    • cyanocyclopropanecarboxylic acid
    • 1-Cyano-cyclopropanecarboxylic acid
    • Cyclopropanecarboxylic acid, 1-cyano-
    • Cyclopropane, 4
    • BDBM82143
    • KSJJMSKNZVXAND-UHFFFAOYSA-N
    • 1-cyanocyclopropane-carboxylic acid
    • 1-Cyano-cyclo-propanecarboxylic acid
    • SBB006670
    • CHEMBL247765
    • DTXSID70369813
    • Z825761122
    • 1-cyano-1-cyclopropane-carboxylic acid
    • 1-cyano-cyclopropane-1-carboxylic acid
    • FG-0700
    • SY001444
    • FT-0649070
    • 1-cyano-1-cyclopropane carboxylic acid
    • AB91792
    • 1-Cyano-1-cyclopropanecarboxylic acid, 97%
    • EN300-114082
    • 1-cyanocyclopropanecarboxylicacid
    • CS-D0590
    • SCHEMBL248308
    • 1-Cyano-1-cyclopropanecarboxylicacid
    • 6914-79-0
    • AKOS000266643
    • MFCD00190651
    • STK503622
    • MDL: MFCD00190651
    • Inchi: 1S/C5H5NO2/c6-3-5(1-2-5)4(7)8/h1-2H2,(H,7,8)
    • InChI Key: KSJJMSKNZVXAND-UHFFFAOYSA-N
    • SMILES: OC(C1(C#N)CC1)=O

Computed Properties

  • Exact Mass: 111.03200
  • Monoisotopic Mass: 111.032
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 172
  • 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
  • Topological Polar Surface Area: 61.1
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0

Experimental Properties

  • Color/Form: Not available
  • Density: 1.3113 (rough estimate)
  • Melting Point: 140?°C (lit.)
  • Boiling Point: 142 °C
  • Flash Point: 150.3°C
  • Refractive Index: 1.4260 (estimate)
  • PSA: 61.09000
  • LogP: 0.37478
  • Solubility: Not available

1-Cyanocyclopropanecarboxylic acid Security Information

  • Symbol: GHS05 GHS07
  • Signal Word:Danger
  • Hazard Statement: H302-H312-H314-H332
  • Warning Statement: P280-P305+P351+P338-P310
  • Hazardous Material transportation number:UN 3261 8/PG 2
  • WGK Germany:3
  • Hazard Category Code: 20/21/22-34
  • Safety Instruction: S26-S27-S36/37/39-S45-S25
  • Hazardous Material Identification: C
  • Packing Group:III
  • Hazard Level:8
  • Risk Phrases:R20/21/22; R34
  • Packing Group:III
  • Safety Term:8
  • HazardClass:8
  • PackingGroup:III

1-Cyanocyclopropanecarboxylic acid 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%

1-Cyanocyclopropanecarboxylic acid Pricemore >>

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