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Vanillyl Butyl Ether

CAS 82654-98-6C12H18O3MW 210.13 g/mol

Vanillyl Butyl Ether (CAS 82654-98-6) — formula C12H18O3, molecular weight 210.13 g/mol; category dyes and pigments.

Product Overview

CAS Number82654-98-6
Molecular FormulaC12H18O3
Molecular Weight210.13 g/mol
Boiling Point241.00 °C. @ 760.00 mm Hg
LogP1.8
Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)
CategoryColoring Agents

Packaging & Storage

Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)

Technical Profile

What this product is

Vanillyl Butyl Ether is a colorant or pigment compound with CAS registry number 82654-98-6 and molecular formula C12H18O3 (molecular weight 210.13 g/mol), belonging to the dyes and pigments segment of chemical raw materials.

Identification

CAS number: 82654-98-6

Its molecular formula C12H18O3 comprises 12 C, 18 H, 3 O atoms.

Also known as: Vanillyl Butyl Ether · 香兰基丁醚

Category: dyes and pigments

Frequently Asked Questions

What is the CAS number of Vanillyl Butyl Ether?

The CAS registry number of Vanillyl Butyl Ether is 82654-98-6.

What is the molecular formula and molecular weight of Vanillyl Butyl Ether?

Molecular formula C12H18O3, molecular weight 210.13 g/mol.

What other names is Vanillyl Butyl Ether known by?

It is also registered under: Vanillyl Butyl Ether, 香兰基丁醚.

Which category does Vanillyl Butyl Ether belong to?

Category: Coloring Agents.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for Vanillyl Butyl Ether (CAS 82654-98-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS Number82654-98-6
PubChem CID5084146
Molecular FormulaC12H18O3
Molecular Weight210.13 g/mol
IUPAC Name4-(butoxymethyl)-2-methoxyphenol
InChIKeyVLDFMKOUUQYFGF-UHFFFAOYSA-N
UNII (FDA)S2ULN37C9R

Computed descriptors

Molecular Weight210.27
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass210.125594432
Monoisotopic Mass210.125594432
Topological Polar Surface Area38.7
Heavy Atom Count15

Physicochemical values on record

Boiling Point241.00 °C. @ 760.00 mm Hg
Boiling Point241 °C
Density1.048-1.068
Refractive Index1.511-1.521

Synonyms and trade names

Vanillyl butyl ether; 4-(Butoxymethyl)-2-methoxyphenol; 82654-98-6; Butyl vanillyl ether; Phenol, 4-(butoxymethyl)-2-methoxy-; FEMA No. 3796; UNII-S2ULN37C9R; S2ULN37C9R; DTXSID2072881; VANILLYL BUTYL ETHER [WHO-DD]; VANILLYL BUTYL ETHER [FHFI]; RefChem:193701; DTXCID8048313; VANILLYL BUTYL ETHER [INCI]; 444-010-7; 617-372-0

Regulatory listings held on file

Regulatory & food contactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Fruit
No safety concern at current levels of intake when used as a flavouring agent
GHS notifications20.9% (37 / 177)

GHS hazard classification

GHS notifications20.9% (37 / 177)
Notified hazard statementsH317 (79.1%), H319 (42.4%), H412 (18.6%), H315 (16.1%)

Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 香兰基丁醚

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