Cas no 63131-30-6 (Ethyl 3-(4-iodophenyl)-3-oxopropanoate)

Ethyl 3-(4-iodophenyl)-3-oxopropanoate structure
63131-30-6 structure
Product Name:Ethyl 3-(4-iodophenyl)-3-oxopropanoate
CAS No:63131-30-6
MF:C11H11IO3
MW:318.107715845108
MDL:MFCD03701540
CID:821584
PubChem ID:24879803
Update Time:2025-04-19

Ethyl 3-(4-iodophenyl)-3-oxopropanoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 3-(4-iodophenyl)-3-oxopropanoate
    • ETHYL (4-IDOBENZOYL) ACETATE
    • Ethyl (4-Iodobenzoyl)Acetate
    • p-Iod-benzoyl-essigsaeureaethylester
    • 4-Iodo-beta-oxobenzenepropanoic acid ethyl ester
    • ethyl 4-iodobenzoylacetate
    • BENZENEPROPANOIC ACID, 4-IODO-BETA-OXO-, ETHYL ESTER
    • DOIUIJYPQHAHLM-UHFFFAOYSA-N
    • CM13720
    • AS06113
    • Ethyl 3-(4-Iodophenyl)-3-oxopropionate
    • AX8127756
    • W7513
    • ST2
    • MDL: MFCD03701540
    • Inchi: 1S/C11H11IO3/c1-2-15-11(14)7-10(13)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3
    • InChI Key: DOIUIJYPQHAHLM-UHFFFAOYSA-N
    • SMILES: IC1C=CC(=CC=1)C(CC(=O)OCC)=O

Computed Properties

  • Exact Mass: 317.97500
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 232
  • 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
  • XLogP3: 2.5
  • Topological Polar Surface Area: 43.4
  • Surface Charge: 0
  • Tautomer Count: 3

Experimental Properties

  • Color/Form: Not available
  • Density: 1.609?g/mL?at 25?°C(lit.)
  • Flash Point: >230?°F
  • Refractive Index: n20/D 1.6070(lit.)
  • Solubility: Very slightly soluble (0.28 g/l) (25 o C),
  • PSA: 43.37000
  • LogP: 2.42710
  • Solubility: Not available

Ethyl 3-(4-iodophenyl)-3-oxopropanoate Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

Ethyl 3-(4-iodophenyl)-3-oxopropanoate Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). 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:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

Ethyl 3-(4-iodophenyl)-3-oxopropanoate Pricemore >>

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