Cas no 110-39-4 (octyl butyrate)

octyl butyrate structure
octyl butyrate structure
Product Name:octyl butyrate
CAS No:110-39-4
MF:C12H24O2
MW:200.317764282227
MDL:MFCD00048939
CID:81898
PubChem ID:61030
Update Time:2025-09-27

octyl butyrate Chemical and Physical Properties

Names and Identifiers

    • octyl butyrate
    • n-Octyl butyrate
    • octyl butanoate
    • butyric acid octyl ester
    • Butanoic acid,octyl ester
    • FEMA 2807
    • 1-OCTYLBUTYRATE
    • OCTYL-N-BUTYRATE
    • CAPRYLYL BUTYRATE
    • n-Octyl butanoate
    • N-OCTYL-N-BUTYRATE
    • octylbutyrate
    • Octylbutanoate
    • Butyric acid, octyl ester (8CI)
    • AKOS015914017
    • Butanoic acid,octylester
    • 110-39-4
    • WE(8:0/4:0)
    • MFCD00048939
    • n-Octyl n-butyrate
    • DTXCID6033162
    • SCHEMBL332746
    • AS-56577
    • DTXSID9059387
    • LMFA07010420
    • CS-0335387
    • CAPRYLYL BUTYRATE [INCI]
    • NSC 72032
    • Butyric acid, octyl ester
    • Octyl butyrate, natural (US), >=95%
    • Octyl butyrate, >=98%, FG
    • D95731
    • BUTANOIC ACID, OCTYL ESTER
    • AI3-24204
    • CHEMBL4634201
    • CHEBI:89726
    • NS00013092
    • Octyl butyrate (natural)
    • 5YEU4O369L
    • OCTYL BUTYRATE [FHFI]
    • NSC-72032
    • EINECS 203-762-4
    • NSC72032
    • Q27161916
    • FEMA No. 2807
    • Butyric acid n-octyl ester
    • UNII-5YEU4O369L
    • MDL: MFCD00048939
    • Inchi: 1S/C12H24O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h3-11H2,1-2H3
    • InChI Key: PWLNAUNEAKQYLH-UHFFFAOYSA-N
    • SMILES: O(C(CCC)=O)CCCCCCCC

Computed Properties

  • Exact Mass: 200.17800
  • Monoisotopic Mass: 200.177630004g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 10
  • Complexity: 132
  • 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
  • XLogP3: 4.2
  • Topological Polar Surface Area: 26.3

Experimental Properties

  • Color/Form: Colorless oily liquid
  • Density: 0.862?g/mL?at 25?°C(lit.)
  • Melting Point: ?56?°C(lit.)
  • Boiling Point: 224?°C(lit.)
  • Flash Point: 218?°F
  • Refractive Index: n20/D 1.425(lit.)
  • PSA: 26.30000
  • LogP: 3.69020
  • Solubility: It is miscible with ethanol and insoluble in water
  • FEMA: 2807 | OCTYL BUTYRATE

octyl butyrate Security Information

  • WGK Germany:3
  • Safety Instruction: S22-S24/25
  • TSCA:Yes
  • Safety Term:S22-S24/25

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abcr
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octyl butyrate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:110-39-4)octyl butyrate
Order Number:A894906
Stock Status:in Stock
Quantity:1kg
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:49
Price ($):177.0

octyl butyrate Related Literature

Recommended suppliers
Amadis Chemical Company Limited
(CAS:110-39-4)octyl butyrate
A894906
Purity:99%
Quantity:1kg
Price ($):177.0
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