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3,4-Hexanedione

CAS 4437-51-8C6H10O2MW 114.07 g/mol

3,4-Hexanedione (CAS 4437-51-8) — formula C6H10O2, molecular weight 114.07 g/mol; category organic chemicals.

Product Description

3,4-Hexanedione (CAS 4437-51-8) is a chemical raw material in the organic chemicals category. Its molecular formula C6H10O2 comprises 6 C, 10 H, 2 O atoms. Its molecular weight is about 114.07 g/mol. Reported physicochemical data: melting point around -10 °C, boiling point around 123.00 to 125.00 °C. @ 760.00 mm Hg, LogP about 0.5. 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 Number4437-51-8
Molecular FormulaC6H10O2
Molecular Weight114.07 g/mol
Melting Point-10 °C
Boiling Point123.00 to 125.00 °C. @ 760.00 mm Hg
LogP0.5
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

3,4-Hexanedione is a carbon-based organic compound with CAS registry number 4437-51-8 and molecular formula C6H10O2 (molecular weight 114.07 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 4437-51-8

Its molecular formula C6H10O2 comprises 6 C, 10 H, 2 O atoms.

Also known as: 3,4-Hexanedione · 3,4-己二酮

Category: organic chemicals / food flavors

Frequently Asked Questions

What is the CAS number of 3,4-Hexanedione?

The CAS registry number of 3,4-Hexanedione is 4437-51-8.

What is the molecular formula and molecular weight of 3,4-Hexanedione?

Molecular formula C6H10O2, molecular weight 114.07 g/mol.

What other names is 3,4-Hexanedione known by?

It is also registered under: 3,4-Hexanedione, 3,4-己二酮.

What are the documented applications of 3,4-Hexanedione?

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 3,4-Hexanedione 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 3,4-Hexanedione (CAS 4437-51-8), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number4437-51-8
PubChem CID62539
Molecular formulaC6H10O2
Molecular weight114.07 g/mol
IUPAC namehexane-3,4-dione
InChIKeyKVFQMAZOBTXCAZ-UHFFFAOYSA-N
UNII (FDA)4M4NPR5VGD
ChEBI IDCHEBI:88652
FEMA number3168
JECFA number413

Computed descriptors

Molecular Weight114.14
XLogP30.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass114.068079557
Monoisotopic Mass114.068079557
Topological Polar Surface Area34.1
Heavy Atom Count8

Physicochemical values on record

Boiling Point123.00 to 125.00 °C. @ 760.00 mm Hg
Boiling Point130 °C
Melting Point-10 °C
Density0.941-0.950 (20 °C)
Refractive Index1.408-1.413

Documented uses on record

  • Flavoring Agents -> JECFA Flavorings Index
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Synonyms and trade names

3,4-HEXANEDIONE; 4437-51-8; hexane-3,4-dione; Diethyl diketone; 3,4-hexane dione; 3,4-hexandione; CCRIS 6295; DTXSID3047681; UNII-4M4NPR5VGD; 4M4NPR5VGD; EINECS 224-651-7; NSC 23255; NSC-23255; DTXCID1027681; 3,4-HEXANEDIONE [FHFI]; RefChem:91251

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
Fat
No safety concern at current levels of intake when used as a flavouring agent

GHS hazard classification

Reported hazard statementsH226 (100%), H315 (94.9%), H319 (94.9%), H331 (94.9%)

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

H315 (94.9%): Causes skin irritation [Warning Skin corrosion/irritation]

What the public record says

3,4-Hexanedione is identified by CAS 4437-51-8, molecular formula C6H10O2 and molecular weight 114.07 g/mol. UNII 4M4NPR5VGD; ChEBI 88652; InChIKey KVFQMAZOBTXCAZ-UHFFFAOYSA-N. Boiling Point: 123.00 to 125.00 °C. @ 760.00 mm Hg; Boiling Point: 130 °C; Melting Point: -10 °C.

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

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 3,4-己二酮

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