Cas no 64206-54-8 (Valeryl salicylate)

Valeryl salicylate structure
Valeryl salicylate structure
Product Name:Valeryl salicylate
CAS No:64206-54-8
MF:C12H14O4
MW:222.237164020538
CID:516558
PubChem ID:24724662
Update Time:2025-04-19

Valeryl salicylate Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-[(1-oxopentyl)oxy]-
    • 2-Valeryloxybenzoic acid Valerylsalicylic acid vsa
    • Valeroyl Salicylate
    • 2-pentanoyloxybenzoic acid
    • Valeryl Salicylate
    • 2-Valeryloxybenzoic acid
    • Valerylsalicylic acid
    • vsa
    • BSPBio_003583
    • Benzoic acid, 2-((1-oxopentyl)oxy)-
    • MFCD00041466
    • O-valerylsalicylic acid
    • CAS_64206-54-8
    • AKOS005359496
    • 64206-54-8
    • SPECTRUM1505336
    • HY-128473
    • O-pentanoylsalicylic acid
    • VALERYL SALYCILATE
    • DA-78817
    • Valeryl Salicylate, >=98% (HPLC)
    • BRN 3292055
    • HMS3649A18
    • 2-(pentanoyloxy)benzoic acid
    • KBio3_002990
    • NCGC00095350-01
    • CHEBI:78250
    • NCGC00095350-03
    • CS-0099287
    • SR-01000946594-1
    • valerylsalicylate
    • 2-[(1-oxopentyl)oxy]-benzoic acid
    • Salicylic acid, valerate
    • BDBM85243
    • WJHZBTMHUNVIKC-UHFFFAOYSA-N
    • DTXSID40214422
    • BRD-K66089377-001-02-0
    • SPBio_000300
    • SCHEMBL6467137
    • Q27147707
    • CHEMBL1359634
    • NCGC00095350-02
    • CCG-38955
    • Spectrum2_000160
    • Spectrum3_001983
    • SR-01000946594
    • Valeryl salicylate
    • MDL: MFCD00041466
    • Inchi: 1S/C12H14O4/c1-2-3-8-11(13)16-10-7-5-4-6-9(10)12(14)15/h4-7H,2-3,8H2,1H3,(H,14,15)
    • InChI Key: WJHZBTMHUNVIKC-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1C(=O)O)C(CCCC)=O

Computed Properties

  • Exact Mass: 222.08900
  • Monoisotopic Mass: 222.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 249
  • 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: nothing
  • Topological Polar Surface Area: 63.6?2

Experimental Properties

  • Color/Form: white
  • Density: 1.2±0.1 g/cm3
  • Melting Point: 86-87?°C (lit.)
  • Boiling Point: 357.6±25.0 °C at 760 mmHg
  • Flash Point: 135.5±16.7 °C
  • Solubility: DMSO: 24?mL/mL
  • PSA: 63.60000
  • LogP: 2.48040
  • Solubility: Soluble in water
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

Valeryl salicylate Security Information

  • Signal Word:warning
  • Hazard Statement: H303+H313+H333
  • Warning Statement: P264+P280+P305+P351+P338+P337+P313
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Safety Instruction: S22-S24/25
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

Valeryl salicylate Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Valeryl salicylate Pricemore >>

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