646-07-1CC(C)CCC(=O)OFGKJLKRYENPLQH-UHFFFAOYSA-NIsocaproic acid is a methyl-branched fatty acid that is pentanoic acid with a methyl group substituent at position 4. It is a metabolite of 20 alpha-hydroxycholesterol. It has a role as a human metabolite. It is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid. It is a conjugate acid of an isocaproate.
646-07-1DTXSID8060951CHEMBL1230308CHEBI:74903199.00 to 201.00 °C. @ 760.00 mm Hg
199-201 °C
This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1591) of reports.
Danger
H311 (98%): Toxic in contact with skin [Danger Acute toxicity, dermal]
P260, P262, P264, P264+P265, P270, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P361+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1591 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Chemical: Pentanoic acid, 4-methyl-
Status: Active Update: 02-06-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19719
4-Methyl pentanoic acid: Does not have an individual approval but may be used under an appropriate group standard
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
개요4-Methylpentanoic acid has an unpleasant sour and penetrating odor.
출처Reported found in apple, roasted barley, beef, prefermented bread, Camembert cheese, Emmenthal cheese, roasted cocoa beans, dry cured ham, hops, roasted pecans, rum, soybeans, black tea, wine, guava, papaya, strawberry fruit and jam, baked potato, bell pepper, tomato, many cheeses, fish, beef, mutton, hop oil, mushrooms, mango, rice, sake, malt, wort, dried bonito and mussels
용도4-Methylvaleric acid has been used in asymmetric synthesis of (4S)-4-isopropyl-3-[(2S)-2,4-dimethyl-valeryl)]-2-oxazolidinone. It is a versatile building block used in the synthesis of various pharmaceutical and biologically active compounds, including inhibitors and antagonists. It is involved in the synthesis of novel series of high affinity, functionally potent antagonists of the CCR1 receptor.
일반 설명Conductimetric detection of 4-methylvaleric acid on unfunctionized polymethacrylate resin (TSKgel G3000PWXL) columns has been reported.
불러오는 중…
slightly brown liquid
정의ChEBI: A methyl-branched fatty acid that is pentanoic acid with a methyl group substituent at position 4. It is a metabolite of 20 alpha-hydroxycholesterol