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线性分子式:
CH3(CH2)6CO2CH2CH2CH(CH3)2
化学文摘社编号:
分子量:
214.34
FEMA Number:
2080
Council of Europe no.:
401
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.120
EC Number:
218-004-8
NACRES:
NA.21
MDL number:
Organoleptic:
coconut; green; waxy; fruity; pineapple; sweet
Grade:
FG
Fragrance grade
Halal
natural
Fragrance grade
Halal
natural
Agency:
follows IFRA guidelines
meets purity specifications of JECFA
meets purity specifications of JECFA
Food allergen:
no known allergens
产品名称
辛酸异戊酯, natural, ≥98%, FG
SMILES string
CCCCCCCC(=O)OCCC(C)C
InChI
1S/C13H26O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-11H2,1-3H3
InChI key
XKWSWANXMRXDES-UHFFFAOYSA-N
grade
FG
Fragrance grade
Halal
natural
agency
follows IFRA guidelines
meets purity specifications of JECFA
reg. compliance
EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117
description
mixture of isoamyl octanoate and 2-methylbutyl octanoate
assay
≥98%
refractive index
n20/D 1.426 (lit.)
bp
267-268 °C
density
0.861 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
organoleptic
coconut; green; waxy; fruity; pineapple; sweet
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Other Notes
天然存在:苏格兰威士忌、波本威士忌、葡萄酒、香蕉、苹果和草莓。
signalword
Warning
hcodes
Hazard Classifications
Skin Irrit. 2
存储类别
10 - Combustible liquids
wgk
WGK 2
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
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