Cas no 581-55-5 (Benzal diacetate)

Benzal diacetate structure
Benzal diacetate structure
Product Name:Benzal diacetate
CAS No:581-55-5
MF:C11H12O4
MW:208.210583686829
MDL:MFCD00059206
CID:82570
PubChem ID:87563224
Update Time:2025-04-18

Benzal diacetate Chemical and Physical Properties

Names and Identifiers

    • Phenylmethylene diacetate
    • Benzal diacetate, (a,a-Diacetoxytoluene)
    • alpha,alpha-Diacetoxytoluene
    • Benzal diacetate
    • [acetyloxy(phenyl)methyl] acetate
    • Benzylidene Diacetate
    • Methanediol, phenyl-, diacetate
    • XRYSDRCNTMEYFH-UHFFFAOYSA-N
    • Benzaldiacetat
    • m-diacetoxymethylbenzene
    • Diacetic acid benzylidene
    • phenylmethanediyl diacetate
    • Phenylmethanediol diacetate
    • acetyloxyphenylmethyl acetate
    • (acetyloxy-phenylmethyl) acetate
    • NSC7732
    • CS-0317610
    • DTXSID60206824
    • UNII-CCF99DS4PJ
    • Acetic acid acetoxy-phenyl-methyl ester
    • AS-58512
    • .ALPHA.,.ALPHA.-DIACETOXYTOLUENE
    • benzaldehyde diacetate
    • DIACETOXYPHENYLMETHANE
    • NS00033875
    • A831761
    • BENZENEMETHANEDIOL DIACETATE
    • (Acetyloxy)(phenyl)methyl acetate
    • NSC-7732
    • AI3-19329
    • B0010
    • CCF99DS4PJ
    • METHANEDIOL, 1-PHENYL-, 1,1-DIACETATE
    • D88587
    • AKOS022176672
    • SCHEMBL486678
    • EINECS 209-469-8
    • (Acetyloxy)(phenyl)methyl acetate #
    • 581-55-5
    • MFCD00059206
    • FT-0622618
    • InChI=1/C11H12O4/c1-8(12)14-11(15-9(2)13)10-6-4-3-5-7-10/h3-7,11H,1-2H
    • NSC 7732
    • 1,1-DIACETOXYMETHYLBENZENE
    • DB-053162
    • DTXCID90129315
    • STL386374
    • MDL: MFCD00059206
    • Inchi: 1S/C11H12O4/c1-8(12)14-11(15-9(2)13)10-6-4-3-5-7-10/h3-7,11H,1-2H3
    • InChI Key: XRYSDRCNTMEYFH-UHFFFAOYSA-N
    • SMILES: O(C(C)=O)C(C1C=CC=CC=1)OC(C)=O

Computed Properties

  • Exact Mass: 208.07400
  • Monoisotopic Mass: 208.074
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 215
  • 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: 1.6
  • Topological Polar Surface Area: 52.6

Experimental Properties

  • Color/Form: Colorless flake crystals.
  • Density: 1.1100
  • Melting Point: 42.0 to 46.0 deg-C
  • Boiling Point: 154°C/20mmHg(lit.)
  • Flash Point: 105.7°C
  • Refractive Index: 1.4570 (estimate)
  • PSA: 52.60000
  • LogP: 1.81140
  • Solubility: Soluble in ethanol \ ether and benzene, insoluble in water

Benzal diacetate Security Information

  • WGK Germany:3
  • Safety Instruction: S22-S26-S37/39
  • RTECS:VV9170000
  • Hazardous Material Identification: Xi
  • Safety Term:S24/25
  • Risk Phrases:R36/37

Benzal diacetate 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%

Benzal diacetate Pricemore >>

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abcr
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Benzal diacetate, 95%; .
581-55-5 95%
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€92.70 2023-07-20
abcr
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