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2,3-hexanedione

CAS 3848-24-6C6H10O2MW 114.07 g/mol

2,3-hexanedione (CAS 3848-24-6) — formula C6H10O2, molecular weight 114.07 g/mol; category organic chemicals.

Product Overview

CAS Number3848-24-6
Molecular FormulaC6H10O2
Molecular Weight114.07 g/mol
Melting Point-30.00 °C. @ 760.00 mm Hg
Boiling Point262 °F at 760 mmHg (NTP, 1992)
LogP0.4
CategoryOrganic Chemicals

Technical Profile

What this product is

2,3-hexanedione is a carbon-based organic compound with CAS registry number 3848-24-6 and molecular formula C6H10O2 (molecular weight 114.07 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 3848-24-6

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

Also known as: 2,3-hexanedione · 2,3-己二酮

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 2,3-hexanedione?

The CAS registry number of 2,3-hexanedione is 3848-24-6.

What is the molecular formula and molecular weight of 2,3-hexanedione?

Molecular formula C6H10O2, molecular weight 114.07 g/mol.

What other names is 2,3-hexanedione known by?

It is also registered under: 2,3-hexanedione, 2,3-己二酮.

Which category does 2,3-hexanedione belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 2,3-hexanedione (CAS 3848-24-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number3848-24-6
PubChem CID19707
Molecular formulaC6H10O2
Molecular weight114.07 g/mol
IUPAC namehexane-2,3-dione
InChIKeyMWVFCEVNXHTDNF-UHFFFAOYSA-N
UNII (FDA)559ANR3NVS
ChEBI IDCHEBI:87583
FEMA number2558
JECFA number412

Computed descriptors

Molecular Weight114.14
XLogP30.4
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 Point262 °F at 760 mmHg (NTP, 1992)
Boiling Point128.00 °C. @ 760.00 mm Hg
Boiling Point128 °C
Melting Point-30.00 °C. @ 760.00 mm Hg
Flash Point83 °F (NTP, 1992)
Density0.930-0.950
Refractive Index1.409-1.419

Documented uses on record

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

Synonyms and trade names

2,3-HEXANEDIONE; 3848-24-6; hexane-2,3-dione; Acetylbutyryl; Acetyl butyryl; Methyl propyl diketone; FEMA No. 2558; DTXSID2047066; 559ANR3NVS; NSC-31665; DTXCID0027066; CHEBI:87583; RefChem:81914; 223-350-8; Hexanedione; Butyryl acetyl

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

GHS hazard classification

Reported hazard statementsH226 (100%), H315 (10.1%), H319 (10.1%), H335 (10.1%), H373 (89.5%)

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

H315 (10.1%): Causes skin irritation [Warning Skin corrosion/irritation]

What the public record says

2,3-hexanedione is identified by CAS 3848-24-6, molecular formula C6H10O2 and molecular weight 114.07 g/mol. UNII 559ANR3NVS; ChEBI 87583; InChIKey MWVFCEVNXHTDNF-UHFFFAOYSA-N. Boiling Point: 262 °F at 760 mmHg (NTP, 1992); Boiling Point: 128.00 °C. @ 760.00 mm Hg; Boiling Point: 128 °C.

Physical description and handling notes

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

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 2,3-己二酮

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