Cas no 42436-07-7 (cis-3-hexenyl phenylacetate)

cis-3-hexenyl phenylacetate structure
cis-3-hexenyl phenylacetate structure
Product Name:cis-3-hexenyl phenylacetate
CAS No:42436-07-7
MF:C14H18O2
MW:218.291524410248
MDL:MFCD00036531
CID:55566
PubChem ID:24901818
Update Time:2025-04-18

cis-3-hexenyl phenylacetate Chemical and Physical Properties

Names and Identifiers

    • cis-3-hexenyl phenylacetate
    • CIS 3 HEXENYL PHENYL ACETATE
    • Phenylacetic acid cis-3-hexen-1-yl ester
    • cis-3-Hexen-1-yl Phenylacetate
    • hex-3-enyl 2-phenylacetate
    • (Z)-Hex-3-enyl phenylacetate
    • MDL: MFCD00036531
    • Inchi: 1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h3-7,9-10H,2,8,11-12H2,1H3/b4-3-
    • InChI Key: FJKFIIYSBXHBCT-ARJAWSKDSA-N
    • SMILES: CC/C=C\CCOC(CC1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 218.13100
  • Monoisotopic Mass: 218.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 7
  • Complexity: 215
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 218
  • XLogP3: 3.7
  • Topological Polar Surface Area: 26.3

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.992
  • Boiling Point: 292-297 oC
  • Flash Point: 110?°C
  • Refractive Index: 1.502
  • PSA: 26.30000
  • LogP: 3.12860
  • FEMA: 3633
  • Solubility: Not determined

cis-3-hexenyl phenylacetate Security Information

  • WGK Germany:2
  • RTECS:CY1630000

cis-3-hexenyl phenylacetate Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. 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, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

cis-3-hexenyl phenylacetate Pricemore >>

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