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Acetylvaleryl

CAS 96-04-8C7H12O2MW 128.17

Acetylvaleryl (CAS 96-04-8) — formula C7H12O2, molecular weight 128.17; category organic chemicals.

Product Description

Acetylvaleryl (CAS 96-04-8) is a organic chemicals. Its molecular formula C7H12O2 comprises 7 C, 12 H, 2 O atoms. Its molecular weight is about 128.17. Reported physicochemical data: boiling point around 64.00 °C. @ 18.00 mm Hg, LogP about 1. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. 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 Number96-04-8
Molecular FormulaC7H12O2
Molecular Weight128.17
Boiling Point64.00 °C. @ 18.00 mm Hg
LogP1
Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)
Applicationsagrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering
CategoryOrganic Chemicals

Applications

Documented applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.

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

Acetylvaleryl is a carbon-based organic compound with CAS registry number 96-04-8 and molecular formula C7H12O2 (molecular weight 128.17), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 96-04-8

Its molecular formula C7H12O2 comprises 7 C, 12 H, 2 O atoms.

Also known as: Acetylvaleryl · 2,3-庚二酮 · 2,3-Heptanedione

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Acetylvaleryl?

The CAS registry number of Acetylvaleryl is 96-04-8.

What is the molecular formula and molecular weight of Acetylvaleryl?

Molecular formula C7H12O2, molecular weight 128.17.

What other names is Acetylvaleryl known by?

It is also registered under: Acetylvaleryl, 2,3-庚二酮, 2,3-Heptanedione.

What are the documented applications of Acetylvaleryl?

Recorded applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.

Which category does Acetylvaleryl belong to?

Category: Organic Chemicals.

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 Acetylvaleryl (CAS 96-04-8), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number96-04-8
PubChem CID60983
Molecular formulaC7H12O2
Molecular weight128.08 g/mol
IUPAC nameheptane-2,3-dione
InChIKeyFJPGAMCQJNLTJC-UHFFFAOYSA-N
UNII (FDA)DK55DDE86P
ChEBI IDCHEBI:88623
FEMA number2543
JECFA number415

Computed descriptors

Molecular Weight128.17
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass128.083729621
Monoisotopic Mass128.083729621
Topological Polar Surface Area34.1
Heavy Atom Count9

Physicochemical values on record

Boiling Point64.00 °C. @ 18.00 mm Hg
Boiling Point62 °C (20 mm Hg)
Density0.917-0.923
Refractive Index1.413-1.416

Documented uses on record

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

Synonyms and trade names

2,3-HEPTANEDIONE; 96-04-8; Heptane-2,3-dione; Acetyl valeryl; Valerylacetyl; Acetyl pentanoyl; FEMA No. 2543; DK55DDE86P; EINECS 202-472-5; NSC 31668; NSC-31668; DTXSID4059128; 2,3-HEPTANDIONE [FCC]; 2,3-HEPTANEDIONE [FHFI]; 2,3-HEPTANDIONE; RefChem:442606

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

GHS hazard classification

Reported hazard statementsH226 (100%), H317 (90.2%)

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

H317 (90.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]

What the public record says

2,3-Heptanedione is identified by CAS 96-04-8, molecular formula C7H12O2 and molecular weight 128.08 g/mol. UNII DK55DDE86P; ChEBI 88623; InChIKey FJPGAMCQJNLTJC-UHFFFAOYSA-N. Boiling Point: 64.00 °C. @ 18.00 mm Hg; Boiling Point: 62 °C (20 mm Hg); Density: 0.917-0.923.

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-庚二酮

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