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Merck
CN

W379603

Sigma-Aldrich

Vanillyl butyl ether

≥96%

Synonym(s):

4-(butoxymethyl)-2-methoxy-Phenol

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About This Item

Linear Formula:
4-(HO)C6H3-3-(OCH3)CH2O(CH2)3CH3
CAS Number:
82654-98-6
Molecular Weight:
210.27
FEMA Number:
3796
MDL number:
MFCD00238529
UNSPSC Code:
12164502
PubChem Substance ID:
24901883
Flavis number:
4.093
Organoleptic:
creamy
Biological source:
synthetic
Food allergen:
no known allergens

Key Documents

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biological source

synthetic

Quality Level

300

Assay

≥96%

refractive index

n20/D 1.516 (lit.)

bp

241 °C (lit.)

density

1.057 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

creamy

SMILES string

CCCCOCC1=CC(OC)=C(O)C=C1

InChI

1S/C12H18O3/c1-3-4-7-15-9-10-5-6-11(13)12(8-10)14-2/h5-6,8,13H,3-4,7,9H2,1-2H3

InChI key

VLDFMKOUUQYFGF-UHFFFAOYSA-N

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General description

Vanillyl butyl ether is an alkoxy-substituted benzyl derivative mainly used as a flavoring agent.

Storage Class Code

12 - Non Combustible Liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKBT2208V
MKBS1079V
STBC8688V
STBC7763V
MKBQ3882V

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Adam TB, et al.
Adam TB, et al.
Food And Chemical Toxicology, 43(8), 1241-1271 (2005)

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