基本情報
- 標準SMILES
CCCCCCCCCCC1CO1- InChIKey
MPGABYXKKCLIRW-UHFFFAOYSA-N- 分子式
- C12H24O
- 平均分子量
- 184.32 g/mol
- 単同位体質量
- 184.18271539
概要
1,2-epoxydodecane is a clear colorless liquid. (NTP, 1992)
名称と識別子
- 優先名称
- 1,2-Epoxydodecane
- IUPAC
- 2-decyloxirane
- 現地名
- 1,2-エポキシドデカン
- 英語名
- 1,2-Epoxydodecane
- 分子式
- C12H24O
- 分子量
- 184.32
名称と別名
名称をさらに表示
データベース識別子
- CAS
2855-19-8- PubChem CID
- 17858
- DTXSID
DTXSID9025243- ChEMBL
CHEMBL3183029- UNII
- 736974CF3U
- EC Number
- 220-667-3
- Nikkaji
- J13.742A
物性
構造計算による物性
- XLogP
- 5.2
- 極性表面積
- 12.5 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
- 9
- 重原子数
- 13
- 形式電荷
- 0
- 複雑度
- 112
実験および物理化学的性質
Flash Point
112 °F (NTP, 1992)
44 °C
Vapor Pressure
6.25 mmHg at 77 °F (NTP, 1992)
6.25 [mmHg]
Physical Description
1,2-epoxydodecane is a clear colorless liquid. (NTP, 1992)
Liquid
Colorless liquid; [CAMEO]
物理化学的性質
- 沸点
- 124 · 124-125 °C/15 mmHg (lit.)
- 比重(密度)
- 0.844 g/mL · 0.844 g/mL at 25 °C (lit.)
- 蒸気圧
- 2 mmHg · 2 mmHg ( 100 °C)
- 屈折率
- 1.435 · 1.435-1.437
- 闪点
- 105 °C · 105 °C
- 貯蔵温度
- 2 · 2-8°C
- 外見
- clear liquid
- 比重
- 0.844 · 0.844
- 色
- Colorless to Almost colorless
- 由来生物
- goat
- 水溶解度
- 水には混和しません。
- BRN
- 105569 · 105569
- InChI
- 1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-12-11-13-12/h12H,2-11H2,1H3
- InChIKey
- MPGABYXKKCLIRW-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCC1CO1
- LogP
- 5.9 at · 5.9 at 20℃
- CAS データベース
- 2855 · 2855-19-8(CAS DataBase Reference)
- NISTの化学物質情報
- Oxirane, decyl-(2855-19-8)
- EPAの化学物質情報
- 1 · 1,2-Epoxydodecane (2855-19-8)
化学的性質
化学的特性clear colorless liquid
安全と法規制
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 174 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H315: Causes skin irritation [Warning Skin corrosion/irritation]
危険有害性情報
Regulatory Information
Chemical: Oxirane, decyl-
Oxirane, 2-decyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Oxirane, 2-decyl- 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)
Status: Active Update: 15-03-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12323
1,2-Epoxydodecane: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
Epoxides, such as 1,2-EPOXYDODECANE, are highly reactive. They polymerize in the presence of catalysts or when heated. These polymerization reactions can be violent. Compounds in this group react with acids, bases, and oxidizing and reducing agents. They react, possibly violently with water in the presence of acid and other catalysts. This chemical is incompatible with strong oxidizers, strong acids and strong bases. It is also incompatible with peroxides. (NTP, 1992)
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Skin irritation - category 2
安全と保護具
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
毒性情報
安全データ
- F
- 10-23
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- JR2450000
- hs_code
- 29109000
- risk_code
- 36/37/38
- 化審法
- (2)-220
- 消防法
- 危-4-3-III
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Hazard Classifications
- Aquatic Acute 1Aquatic Chronic 1Skin Irrit. 2
- ストレージクラス
- 10 - Combustible liquids
- 有毒物質データの
- 2855-19-8(Hazardous Substances Data)
化学と産業
用途と製造
Uses
Used as a secondary heat stabilizer for polymers; No known commercial production in the US; [HSDB]
SECONDARY HEAT STABILIZER FOR POLYMERS
U.S. Exports
(1979) No Data
(1981) No Data
U.S. Imports
(1979) No Data
(1981) No Data
U.S. Production
2023: 34,534 lb
(1979) NO EVIDENCE OF COMMERCIAL PRODN IN U.S.
(1981) NO EVIDENCE OF COMMERCIAL PRODN IN U.S.
General Manufacturing Information
Transportation Equipment Manufacturing
Oxirane, 2-decyl-: ACTIVE
応用分野
用途有機合成原料。
使用In the production of epoxy resins, 1,2-Epoxydodecane is used as a reactive diluent and cross-linking agent which can help to improve the performance and versatility of these industrial materials. In the production of emulsions, foams, and dispersants, 1,2-Epoxydodecane can be used as a surfactant. In pharmaceutical industry, 1,2-Epoxydodecane can be used as a solvent in the production of certain pharmaceuticals, like pyrazolones. In the synthesis of hydroxyurea, 1,2-epoxydodecane is used as an intermediate in the production of a key starting material.
一般的な説明Clear colorless liquid.
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