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2-Methylhexanoic acid

CAS 4536-23-6C7H14O2MW 130.10 g/mol

2-Methylhexanoic acid (CAS 4536-23-6) — formula C7H14O2, molecular weight 130.10 g/mol; category organic chemicals.

Product Description

2-Methylhexanoic acid (CAS 4536-23-6) is a chemical raw material in the organic chemicals category. Its molecular formula C7H14O2 comprises 7 C, 14 H, 2 O atoms. Its molecular weight is about 130.10 g/mol. Reported physicochemical data: boiling point around 105 °C (5 mm Hg), LogP about 2.3. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number4536-23-6
Molecular FormulaC7H14O2
Molecular Weight130.10 g/mol
Boiling Point105 °C (5 mm Hg)
LogP2.3
Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)
Applications典型应用领域:食品增香, 日化。规格/纯度:以批次 COA 为准。包装:25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 密封保存
CategoryOrganic Chemicals|Flavors

Applications

Documented applications: 典型应用领域:食品增香, 日化。规格/纯度:以批次 COA 为准。包装:25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 密封保存.

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

2-Methylhexanoic acid is a carbon-based organic compound with CAS registry number 4536-23-6 and molecular formula C7H14O2 (molecular weight 130.10 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 4536-23-6

Its molecular formula C7H14O2 comprises 7 C, 14 H, 2 O atoms.

Also known as: 2-Methylhexanoic acid · 2-甲基己酸

Category: organic chemicals / food flavors

Frequently Asked Questions

What is the CAS number of 2-Methylhexanoic acid?

The CAS registry number of 2-Methylhexanoic acid is 4536-23-6.

What is the molecular formula and molecular weight of 2-Methylhexanoic acid?

Molecular formula C7H14O2, molecular weight 130.10 g/mol.

What other names is 2-Methylhexanoic acid known by?

It is also registered under: 2-Methylhexanoic acid, 2-甲基己酸.

What are the documented applications of 2-Methylhexanoic acid?

Recorded applications: 典型应用领域:食品增香, 日化。规格/纯度:以批次 COA 为准。包装:25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 密封保存.

Which category does 2-Methylhexanoic acid belong to?

Category: Organic Chemicals / Flavors.

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 2-Methylhexanoic acid (CAS 4536-23-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number4536-23-6
PubChem CID20653
Molecular formulaC7H14O2
Molecular weight130.10 g/mol
IUPAC name2-methylhexanoic acid
InChIKeyCVKMFSAVYPAZTQ-UHFFFAOYSA-N
UNII (FDA)LUK37N0QM8
ChEBI IDCHEBI:138489
FEMA number3191
JECFA number265

Computed descriptors

Molecular Weight130.18
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass130.099379685
Monoisotopic Mass130.099379685
Topological Polar Surface Area37.3
Heavy Atom Count9

Physicochemical values on record

Boiling Point105 °C (5 mm Hg)
Density0.914-0.918 (20 °C/20 °C)
Refractive Index1.419-1.422 (20 °C)

Documented uses on record

    Flavoring Agents -> JECFA Flavorings IndexFlavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

    Synonyms and trade names

    2-METHYLHEXANOIC ACID; 4536-23-6; 2-Methylcaproic acid; Hexanoic acid, 2-methyl-; 2-Hexanecarboxylic acid; alpha-Methylcaproic acid; 2-methyl-hexanoic acid; FEMA No. 3191; .alpha.-Methylcaproic acid; DTXSID9044241; EINECS 224-883-9; LUK37N0QM8; BRN 1721227; DTXCID7024241; CVKMFSAVYPAZTQ-UHFFFAOYSA-; 2-METHYLHEXANOIC ACID [FHFI]

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Dairy
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary0.3% (5 / 1924)

    GHS hazard classification

    GHS notification summary0.3% (5 / 1924)
    Reported hazard statementsH315 (91%), H318 (25.6%), H319 (68%)

    This chemical does not meet GHS hazard criteria for 0.3% (5 of 1924) of reports.

    H315 (91%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    2-Methylhexanoic acid is identified by CAS 4536-23-6, molecular formula C7H14O2 and molecular weight 130.10 g/mol. UNII LUK37N0QM8; ChEBI 138489; InChIKey CVKMFSAVYPAZTQ-UHFFFAOYSA-N. Boiling Point: 105 °C (5 mm Hg); Density: 0.914-0.918 (20 °C/20 °C); Refractive Index: 1.419-1.422 (20 °C).

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

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中文页面: 2-甲基己酸

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