W319104
2-甲基己酸
≥99%, FG
别名:
2-甲己酸
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关于此项目
线性分子式:
CH3(CH2)3CH(CH3)COOH
化学文摘社编号:
分子量:
130.18
FEMA Number:
3191
Council of Europe no.:
582
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
8.035
EC Number:
224-883-9
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
1721227
Organoleptic:
fatty; lard; oily; acidic
Grade:
FG, Fragrance grade, Halal, Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines, meets purity specifications of JECFA
Food allergen:
no known allergens
biological source
synthetic
grade
FG, Fragrance grade, Halal, Kosher
agency
follows IFRA guidelines, meets purity specifications of JECFA
reg. compliance
EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002
assay
≥99%
refractive index
n20/D 1.422 (lit.)
bp
209-210 °C (lit.)
density
0.918 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
fatty; lard; oily; acidic
SMILES string
CCCCC(C)C(O)=O
InChI
1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
InChI key
CVKMFSAVYPAZTQ-UHFFFAOYSA-N
General description
2-methylhexanoic acid has been identified as one of the volatile flavor compounds in the peel and pulp of doum fruit.
Application
- Update to RIFM fragrance ingredient safety assessment, 2-methylhexanoic acid, CAS registry number 4536-23-6.: This study updates the safety assessment of 2-methylhexanoic acid used in fragrance applications (Api et al., 2024).
- Sustainable Biocatalytic Procedure for Obtaining New Branched Acid Esters.: This paper presents a novel biocatalytic method for synthesizing branched acid esters, utilizing 2-methylhexanoic acid as a precursor (Montiel et al., 2021).
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Danger
hcodes
Hazard Classifications
Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
134.6 °F - closed cup
flash_point_c
57 °C - closed cup
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter