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Merck
CN

W220108

己酸丁酯

≥98%, FG

别名:

Butyl caproate, NSC 4022, 己酸丁酯

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关于此项目

线性分子式:
CH3(CH2)4CO2(CH2)3CH3
化学文摘社编号:
分子量:
172.26
FEMA Number:
2201
Council of Europe no.:
313
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.063
EC Number:
210-964-6
NACRES:
NA.21
MDL number:
Organoleptic:
berry; fruity
Grade:
FG, Halal, Kosher
Biological source:
synthetic
Agency:
meets purity specifications of JECFA
Food allergen:
no known allergens
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biological source

synthetic

Quality Level

grade

FG, Halal, Kosher

agency

meets purity specifications of JECFA

reg. compliance

EU Regulation 1334/2008 & 178/2002, FDA 21 CFR 117, FDA 21 CFR 172.515

assay

≥98%

refractive index

n20/D 1.416 (lit.)

bp

61-62 °C/3 mmHg (lit.)

density

0.866 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

berry; fruity

SMILES string

CCCCCC(=O)OCCCC

InChI

1S/C10H20O2/c1-3-5-7-8-10(11)12-9-6-4-2/h3-9H2,1-2H3

InChI key

RPRPDTXKGSIXMD-UHFFFAOYSA-N

General description

Butyl hexanoate is an aliphatic ester that can be used as a flavoring agent. It is one of the main volatile compounds found in apples. Along with red sticky sphere traps, butyl hexanoate can also act as an odor lure for apple maggot flies.


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存储类别

10 - Combustible liquids

wgk

WGK 2

flash_point_f

177.8 °F - closed cup

flash_point_c

81 °C - closed cup



历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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相关内容


M Guadalupe Sánchez-Otero et al.
Environmental technology, 31(10), 1101-1106 (2010-08-20)
The recombinant lipase LipMatCCR11 from the thermophilic strain Geobacillus thermoleovorans CCR11 was applied in the synthesis of n-butyl caproate via transesterification in hexane and xylene. The short chain flavour ester was obtained by alcoholysis from ethyl caproate and n-butyl alcohol
Burdock GA
Encyclopedia of Food and Color Additives, 1, 341-342 (1997)
K Takahashi et al.
Biochemical and biophysical research communications, 131(2), 532-536 (1985-09-16)
Lipoprotein lipase was modified with 2,4-bis(O-methoxypolyethylene glycol)-6-chloro-s-triazine; forty-six percent out of seven amino groups in the molecule were substituted. The modified lipase catalyzed ester-exchange reactions between an ester and an alcohol, between an ester and an acid, and between two



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