2-Methylhexanoic acid (CAS No. 4536-23-6) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Organic Chemicals；Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.
Organic Chemicals；Flavors
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The CAS number of 2-Methylhexanoic acid is 4536-23-6.
Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.
Main applications include Organic Chemicals；Flavors.
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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).
| CAS Registry Number | 4536-23-6 |
|---|---|
| PubChem CID | 20653 |
| Molecular formula | C7H14O2 |
| Molecular weight | 130.10 g/mol |
| IUPAC name | 2-methylhexanoic acid |
| InChIKey | CVKMFSAVYPAZTQ-UHFFFAOYSA-N |
| UNII (FDA) | LUK37N0QM8 |
| ChEBI ID | CHEBI:138489 |
| FEMA number | 3191 |
| JECFA number | 265 |
| Molecular Weight | 130.18 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 130.099379685 |
| Monoisotopic Mass | 130.099379685 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Boiling Point | 105 °C (5 mm Hg) |
|---|---|
| Density | 0.914-0.918 (20 °C/20 °C) |
| Refractive Index | 1.419-1.422 (20 °C) |
| Regulatory & Food Contact | EU 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 summary | 0.3% (5 / 1924) |
| GHS notification summary | 0.3% (5 / 1924) |
|---|---|
| Reported hazard statements | H315 (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]
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]
CAS 4536-23-6; molecular formula C7H14O2; molecular weight 130.10 g/mol.
2-METHYLHEXANOIC ACID, 4536-23-6, 2-Methylcaproic acid, Hexanoic acid, 2-methyl-, 2-Hexanecarboxylic acid, alpha-Methylcaproic acid.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
0.3% of GHS notifications report no hazard classification (5 of 1924).
Boiling Point: 105 °C (5 mm Hg); Density: 0.914-0.918 (20 °C/20 °C); Refractive Index: 1.419-1.422 (20 °C).
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.
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