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Magnesium bis(3-methyl-1-butanolate)

CAS 6423-06-9C5H12OMW 88.15

Magnesium bis(3-methyl-1-butanolate) (CAS 6423-06-9) — formula C5H12O, molecular weight 88.15; category organic chemicals.

Product Overview

CAS Number6423-06-9
Molecular FormulaC5H12O
Molecular Weight88.15
Melting Point-179 °F (NIOSH, 2024)
Boiling Point270 °F at 760 mmHg (USCG, 1999)
LogP1.2
ApplicationsUses: Used as a solvent, paint stripper, and intermediate in the photographic and pharmaceutical industries, [ACGIH], Painting (Solvents) [Category: Paint], Photographic Processing [Category: Other], SYNTHETIC FLAVOR, INTERMEDIATE IN PREPN OF PHARMACEUTICALS, FOR ISOAMYL ACETATE AND OTHER ESTERS, FOR DITHIOPHOSPHATE ESTERS (LUBRICATING OIL ADDITIVE AND HYDRAULIC FLUID ADDITIVE), SOLVENT FOR FATS, RESINS, ALKALOIDS, ETC, MFR ISOAMYL (AMYL) COMPD, ISOVALERIC ACID, MERCURY FULMINATE, MFR PYROXYLIN, ARTIFICIAL SILK, LACQUERS, SMOKELESS POWDERS, IN MICROSCOPY, FOR DEHYDRATING CELLOIDIN SOLN, FOR DETERMINING FAT IN MILK, REPORTED USES: NON-ALCOHOLIC BEVERAGES 17 PPM, ALCOHOLIC BEVERAGES 100 PPM, ICE CREAM, ICES, ETC 7.6 PPM, CANDY 52 PPM, BAKED GOODS 24 PPM, GELATINS & PUDDINGS 46 PPM, CHEWING GUM 300 PPM., Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Solvent, Industry Uses: Solvent, Flotation agent, Methods of Manufacturing: FROM ISOBUTYLENE, VIA THE OXO PROCESS, FROM LIGHT PETROLEUM BY FRACTIONAL DISTILLATION, DEHYDRATION OF PENTANE FRACTION WHICH IS THEN HEATED & RE-FRACTIONATED, & AMYLCHLORIDE FRACTION AGAIN FRACTIONALLY DISTILLED, GIVING MONO-CHLORO-PENTANE MIXTURE. THIS IS SUBJECTED TO HYDROLYSIS WITH SODIUM OLEATE SOLN IN PRESENCE OF CATALYST., ... MFR BY FRACTIONATION OF FUSEL OIL & VIA CHLORINATION OF PENTANES, & PROPERTIES, PREPN FROM BUTADIENE, CARBON MONOXIDE, WATER, PLUS CATALYST, FROM METHYLBUTENES, Formulations, Preparations: MAJOR COMPONENT OF COMMERCIAL AMYL ALCOHOL, FUSEL OIL & POTATO-SPIRIT OIL., GRADE: TECHNICAL, FUSEL OIL, U.S. Production: 2023: 50, 000 - <75, 000 lb, 2022: 25, 000 - <50, 2021: <25, 2020: 100, 000 - <250, (1962) 5.5-6.8X10+9 GRAMS (ALL AMYL ALCOHOLS), U.S. Imports: (1984) 1.89X10+8 G, AMYL ALCOHOLS, General Manufacturing Information: Mining (except Oil and Gas) and support activities, Paint and Coating Manufacturing, Fabricated Metal Product Manufacturing, 1-Butanol, 3-methyl-: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Uses: Used as a solvent, paint stripper, and intermediate in the photographic and pharmaceutical industries, [ACGIH], Painting (Solvents) [Category: Paint], Photographic Processing [Category: Other], SYNTHETIC FLAVOR, INTERMEDIATE IN PREPN OF PHARMACEUTICALS, FOR ISOAMYL ACETATE AND OTHER ESTERS, FOR DITHIOPHOSPHATE ESTERS (LUBRICATING OIL ADDITIVE AND HYDRAULIC FLUID ADDITIVE), SOLVENT FOR FATS, RESINS, ALKALOIDS, ETC, MFR ISOAMYL (AMYL) COMPD, ISOVALERIC ACID, MERCURY FULMINATE, MFR PYROXYLIN, ARTIFICIAL SILK, LACQUERS, SMOKELESS POWDERS, IN MICROSCOPY, FOR DEHYDRATING CELLOIDIN SOLN, FOR DETERMINING FAT IN MILK, REPORTED USES: NON-ALCOHOLIC BEVERAGES 17 PPM, ALCOHOLIC BEVERAGES 100 PPM, ICE CREAM, ICES, ETC 7.6 PPM, CANDY 52 PPM, BAKED GOODS 24 PPM, GELATINS & PUDDINGS 46 PPM, CHEWING GUM 300 PPM., Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Solvent, Industry Uses: Solvent, Flotation agent, Methods of Manufacturing: FROM ISOBUTYLENE, VIA THE OXO PROCESS, FROM LIGHT PETROLEUM BY FRACTIONAL DISTILLATION, DEHYDRATION OF PENTANE FRACTION WHICH IS THEN HEATED & RE-FRACTIONATED, & AMYLCHLORIDE FRACTION AGAIN FRACTIONALLY DISTILLED, GIVING MONO-CHLORO-PENTANE MIXTURE. THIS IS SUBJECTED TO HYDROLYSIS WITH SODIUM OLEATE SOLN IN PRESENCE OF CATALYST., ... MFR BY FRACTIONATION OF FUSEL OIL & VIA CHLORINATION OF PENTANES, & PROPERTIES, PREPN FROM BUTADIENE, CARBON MONOXIDE, WATER, PLUS CATALYST, FROM METHYLBUTENES, Formulations, Preparations: MAJOR COMPONENT OF COMMERCIAL AMYL ALCOHOL, FUSEL OIL & POTATO-SPIRIT OIL., GRADE: TECHNICAL, FUSEL OIL, U.S. Production: 2023: 50, 000 - <75, 000 lb, 2022: 25, 000 - <50, 2021: <25, 2020: 100, 000 - <250, (1962) 5.5-6.8X10+9 GRAMS (ALL AMYL ALCOHOLS), U.S. Imports: (1984) 1.89X10+8 G, AMYL ALCOHOLS, General Manufacturing Information: Mining (except Oil and Gas) and support activities, Paint and Coating Manufacturing, Fabricated Metal Product Manufacturing, 1-Butanol, 3-methyl-: ACTIVE.

Technical Profile

What this product is

Magnesium bis(3-methyl-1-butanolate) is a carbon-based organic compound with CAS registry number 6423-06-9 and molecular formula C5H12O (molecular weight 88.15), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 6423-06-9

Its molecular formula C5H12O comprises 5 C, 12 H, 1 O atoms.

Also known as: Magnesium bis(3-methyl-1-butanolate) · 双(3-甲基-1-丁醇)镁

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Magnesium bis(3-methyl-1-butanolate)?

The CAS registry number of Magnesium bis(3-methyl-1-butanolate) is 6423-06-9.

What is the molecular formula and molecular weight of Magnesium bis(3-methyl-1-butanolate)?

Molecular formula C5H12O, molecular weight 88.15.

What other names is Magnesium bis(3-methyl-1-butanolate) known by?

It is also registered under: Magnesium bis(3-methyl-1-butanolate), 双(3-甲基-1-丁醇)镁.

What are the documented applications of Magnesium bis(3-methyl-1-butanolate)?

Recorded applications: Uses: Used as a solvent, paint stripper, and intermediate in the photographic and pharmaceutical industries, [ACGIH], Painting (Solvents) [Category: Paint], Photographic Processing [Category: Other], SYNTHETIC FLAVOR, INTERMEDIATE IN PREPN OF PHARMACEUTICALS, FOR ISOAMYL ACETATE AND OTHER ESTERS, FOR DITHIOPHOSPHATE ESTERS (LUBRICATING OIL ADDITIVE AND HYDRAULIC FLUID ADDITIVE), SOLVENT FOR FATS, RESINS, ALKALOIDS, ETC, MFR ISOAMYL (AMYL) COMPD, ISOVALERIC ACID, MERCURY FULMINATE, MFR PYROXYLIN, ARTIFICIAL SILK, LACQUERS, SMOKELESS POWDERS, IN MICROSCOPY, FOR DEHYDRATING CELLOIDIN SOLN, FOR DETERMINING FAT IN MILK, REPORTED USES: NON-ALCOHOLIC BEVERAGES 17 PPM, ALCOHOLIC BEVERAGES 100 PPM, ICE CREAM, ICES, ETC 7.6 PPM, CANDY 52 PPM, BAKED GOODS 24 PPM, GELATINS & PUDDINGS 46 PPM, CHEWING GUM 300 PPM., Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Solvent, Industry Uses: Solvent, Flotation agent, Methods of Manufacturing: FROM ISOBUTYLENE, VIA THE OXO PROCESS, FROM LIGHT PETROLEUM BY FRACTIONAL DISTILLATION, DEHYDRATION OF PENTANE FRACTION WHICH IS THEN HEATED & RE-FRACTIONATED, & AMYLCHLORIDE FRACTION AGAIN FRACTIONALLY DISTILLED, GIVING MONO-CHLORO-PENTANE MIXTURE. THIS IS SUBJECTED TO HYDROLYSIS WITH SODIUM OLEATE SOLN IN PRESENCE OF CATALYST., ... MFR BY FRACTIONATION OF FUSEL OIL & VIA CHLORINATION OF PENTANES, & PROPERTIES, PREPN FROM BUTADIENE, CARBON MONOXIDE, WATER, PLUS CATALYST, FROM METHYLBUTENES, Formulations, Preparations: MAJOR COMPONENT OF COMMERCIAL AMYL ALCOHOL, FUSEL OIL & POTATO-SPIRIT OIL., GRADE: TECHNICAL, FUSEL OIL, U.S. Production: 2023: 50, 000 - <75, 000 lb, 2022: 25, 000 - <50, 2021: <25, 2020: 100, 000 - <250, (1962) 5.5-6.8X10+9 GRAMS (ALL AMYL ALCOHOLS), U.S. Imports: (1984) 1.89X10+8 G, AMYL ALCOHOLS, General Manufacturing Information: Mining (except Oil and Gas) and support activities, Paint and Coating Manufacturing, Fabricated Metal Product Manufacturing, 1-Butanol, 3-methyl-: ACTIVE.

Which category does Magnesium bis(3-methyl-1-butanolate) belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Magnesium bis(3-methyl-1-butanolate) (CAS 6423-06-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号6423-06-9
PubChem CID31260
分子式C5H12O
IUPAC 名称3-methylbutan-1-ol
UNII(FDA)DEM9NIT1J4
FEMA 编号2057
JECFA 编号52

Computed descriptors

Molecular Weight88.15
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass88.088815002
Monoisotopic Mass88.088815002
Topological Polar Surface Area20.2
Heavy Atom Count6

Physicochemical values on record

Boiling Point270 °F at 760 mmHg (USCG, 1999)
Boiling Point132.5 °C
Boiling Point131.00 to 133.00 °C. @ 760.00 mm Hg
Boiling Point132 °C
Boiling Point130 °C
Boiling Point270 °F
Boiling Point131.1 °C @760 [mm Hg]
Melting Point-179 °F (NIOSH, 2024)
Melting Point-117.2 °C
Melting Point-117 °C

Synonyms and trade names

Isoamyl alcohol; 3-Methyl-1-butanol; Isopentyl alcohol; 123-51-3; 3-Methylbutan-1-ol; Isopentanol; 3-Methylbutanol; 1-Butanol, 3-methyl-; Isoamylol; Isobutylcarbinol; 2-Methyl-4-butanol; Isobutyl carbinol; Iso-amylalkohol; ISOAMYLALCOHOL; Alcool isoamylique; Amylowy alkohol

Regulatory listings held on file

法规与食品接触EU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Burnt, Cocoa, Floral, Malt
JECFA ADI: 0-3 mg/kg bw (1979)

GHS hazard classification

已通报的危害声明H226 (99.2%), H302 (17.7%), H315 (69.5%), H318 (10.3%), H319 (70.4%), H332 (80.5%), H335 (82.6%), H336

What the public record says

双(3-甲基-1-丁醇)镁 · CAS 6423-06-9 · C5H12O. UNII DEM9NIT1J4. Boiling Point: 270 °F at 760 mmHg (USCG, 1999); Boiling Point: 132.5 °C; Boiling Point: 131.00 to 133.00 °C. @ 760.00 mm Hg.

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

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