基本情報
- CAS
19549-80-5- 標準SMILES
CC(=O)CC(C)CC(C)C- InChIKey
YXFDTUKUWNQPFV-UHFFFAOYSA-N- 分子式
- C9H18O
- 平均分子量
- 142.24 g/mol
- 単同位体質量
- 142.13576519
名称と識別子
- 優先名称
- 2-Heptanone, 4,6-dimethyl-
- IUPAC
- 4,6-dimethylheptan-2-one
- 現地名
- 4,6-ジメチル-2-ヘプタノン
- 英語名
- 4,6-DIMETHYL-2-HEPTANONE
- 分子式
- C9H18O
- 分子量
- 142.24
名称と別名
19549-80-54,6-Dimethyl-2-heptanone2-Heptanone, 4,6-dimethyl-EINECS 243-148-3DTXSID20527844,6Dimethyl2heptanone4,6Dimethylheptan2oneRefChem:87248DTXCID60210587YXFDTUKUWNQPFV-UHFFFAOYSA-N4,6-Dimethylheptan-2-oneMFCD00048360
名称をさらに表示
4,6-ジメチル-2-ヘプタノン4，6-ジメチルヘプタン-2-オン4,6-dimethyl-2-heptanon
4,6-dimethylheptanoneSCHEMBL183207SCHEMBL28092510UAA54980AKOS006275380DS-6352DB-065885CS-0449098
データベース識別子
- CAS
19549-80-5- PubChem CID
- 89180
- DTXSID
DTXSID2052784- EC Number
- 243-148-3
- Nikkaji
- J242.853I
物性
構造計算による物性
- XLogP
- 2.5
- 極性表面積
- 17.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 4
- 重原子数
- 10
- 形式電荷
- 0
- 複雑度
- 105
実験および物理化学的性質
SolventsSolvents -> Ketones (<C12)
Physical DescriptionCBI
物理化学的性質
- 沸点
- 190 · 190-191 °C
- 比重(密度)
- 0.9024 g/cm3 · 0.9024 g/cm3(Temp: 0 °C)
- 貯蔵温度
- 2 · 2-8°C
- EPAの化学物質情報
- 2 · 2-Heptanone, 4,6-dimethyl- (19549-80-5)
化学的性質
化学的特性Colorless or light yellow transparent liquid
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 78% (298 of 382) of all reports.
Warning
H226 (22%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P271, P280, P303+P361+P353, P304+P340, P319, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 382 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
2-Heptanone, 4,6-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Heptanone, 4,6-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
2-Heptanone, 4,6-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryA skin and eye irritant; [ChemSampCo MSDS] See Diisobutyl ketone.
Hazard Classes and CategoriesFlam. Liq. 3 (22%)
毒性情報
Adverse EffectsNeurotoxin - Acute solvent syndrome
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
U.S. Production2023: <50,000 lb
Industry UsesSolvent
General Manufacturing Information
Electrical Equipment, Appliance, and Component Manufacturing
2-Heptanone, 4,6-dimethyl-: ACTIVE
上流・下流製品情報
下流製品
サプライヤー31 社
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Dalian Ruiying Technology Co., Ltd.+86-0411-86907150 +86-15940963210 · [email protected]
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