2-Octanone

Name: 2-Octanone
Brand: Jinan Shenghe Chemical Co., Ltd.
SKU: 160142

CAS 111-13-7C8H16OMW 128.12 g/mol

2-Octanone (CAS 111-13-7) — formula C8H16O, molecular weight 128.12 g/mol.

Product Overview

CAS Number	111-13-7
Molecular Formula	C8H16O
Molecular Weight	128.12 g/mol
Melting Point	-16 °C
Boiling Point	173.5
LogP	2.4
Packaging	25/50kg 编织袋、20/25/50kg 纸板桶、200kg 塑料桶、1000kg IBC（以订单确认为准）
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, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。

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, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.

Packaging & Storage

Packaging25/50kg 编织袋、20/25/50kg 纸板桶、200kg 塑料桶、1000kg IBC（以订单确认为准）

Technical Profile

What this product is

2-Octanone is a chemical compound with CAS registry number 111-13-7 and molecular formula C8H16O (molecular weight 128.12 g/mol).

Identification

CAS number: 111-13-7

Its molecular formula C8H16O comprises 8 C, 16 H, 1 O atoms.

Also known as: 2-Octanone · 2-辛酮

Frequently Asked Questions

What is the CAS number of 2-Octanone?

The CAS registry number of 2-Octanone is 111-13-7.

What is the molecular formula and molecular weight of 2-Octanone?

Molecular formula C8H16O, molecular weight 128.12 g/mol.

What other names is 2-Octanone known by?

It is also registered under: 2-Octanone, 2-辛酮.

What are the documented applications of 2-Octanone?

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, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.

PubChem Public Data

Independent reference data for 2-Octanone (CAS 111-13-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号	111-13-7
PubChem CID	8093
分子式	C8H16O
分子量	128.12 g/mol
IUPAC 名称	octan-2-one
InChIKey	ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
UNII（FDA）	J2G84H29AF
ChEBI 编号	CHEBI:87434
FEMA 编号	2802
JECFA 编号	288

Computed descriptors

Molecular Weight	128.21
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	128.120115130
Monoisotopic Mass	128.120115130
Topological Polar Surface Area	17.1
Heavy Atom Count	9

Physicochemical values on record

Boiling Point	173.5
Boiling Point	173.00 to 175.00 °C. @ 760.00 mm Hg
Boiling Point	174-175 °C
Boiling Point	172.5 °C @760 [mm Hg]
Melting Point	-16 °C
Flash Point	125 °F (52 °C) (Closed cup)
Solubility	In water, 899 mg/L at 20 °C
Solubility	0.899 mg/mL at 20 °C
Density	0.820 at 20 °C/4 °C
Density	0.813-0.819

Synonyms and trade names

2-OCTANONE; Octan-2-one; 111-13-7; Hexyl methyl ketone; Methyl hexyl ketone; n-Hexyl methyl ketone; Methyl n-hexyl ketone; 2-Oxooctane; FEMA No. 2802; FEMA Number 2802; J2G84H29AF; DTXSID4021927; NSC-3712; CHEBI:87434; RefChem:88855; DTXCID301927

Regulatory listings held on file

法规与食品接触	EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fat, Fragrant, Mold No safety concern at current levels of intake when used as a flavouring agent
GHS 通报统计	0.8% (15 / 1970)

GHS hazard classification

GHS 通报统计	0.8% (15 / 1970)
已通报的危害声明	H226 (99%), H319, H336

What the public record says

2-辛酮的 CAS 号为 111-13-7，分子式 C8H16O，分子量 128.12 g/mol。 UNII J2G84H29AF; ChEBI 87434; InChIKey ZPVFWPFBNIEHGJ-UHFFFAOYSA-N. Boiling Point: 173.5; Boiling Point: 173.00 to 175.00 °C. @ 760.00 mm Hg; Boiling Point: 174-175 °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: 2-辛酮