W254606

4-Heptanone

≥97%, FG

• Synonym(s): Butyrone, Dipropyl ketone
• Linear Formula: (CH₃CH₂CH₂)₂CO
• CAS Number: 123-19-3
• Molecular Weight: 114.19
• FEMA Number: 2546
• Beilstein: 1699049
• EC Number: 204-608-9
• Council of Europe no.: 2034
• MDL number: MFCD00009403
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901133
• Flavis number: 7.058
• NACRES: NA.21

Properties

• biological source: synthetic
• Quality Level: 400
• grade: FG; Fragrance grade; Halal
• Agency: follows IFRA guidelines
• reg. compliance: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002; FDA 21 CFR 117; FDA 21 CFR 172.515
• vapor density: 3.93 (vs air)
• vapor pressure: 5.2 mmHg ( 20 °C)
• Assay: ≥97%
• refractive index: n20/D 1.407 (lit.)
• bp: 145 °C (lit.)
• mp: −33 °C (lit.)
• density: 0.817 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• fragrance allergen: no known allergens
• Organoleptic: cheese; fruity; pineapple; sweet
• SMILES string: CCCC(=O)CCC
• InChI: 1S/C7H14O/c1-3-5-7(8)6-4-2/h3-6H2,1-2H3
• InChI key: HCFAJYNVAYBARA-UHFFFAOYSA-N

Description

Biochem/physiol Actions

Taste at 5 ppm

Other Notes

Natural occurrence: Baked potato, cabbage, coffee, papaya, roasted peanut.

Safety Information

• Pictograms: GHS02,GHS07
• Signal Word: Warning
• Hazard Statements: H226,H332
• Precautionary Statements: P210 - P233 - P240 - P241 - P242 - P304 + P340 + P312
• Hazard Classifications: Acute Tox. 4 Inhalation - Flam. Liq. 3
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 2
• Flash Point(F): 120.2 °F - closed cup
• Flash Point(C): 49 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves