基本情報
- CAS
692-49-9- 標準SMILES
FC(F)(F)/C=C\C(F)(F)F- InChIKey
NLOLSXYRJFEOTA-UPHRSURJSA-N- 分子式
- C4H2F6
- 平均分子量
- 164.05 g/mol
- 単同位体質量
- 164.00606904
名称と識別子
- 優先名称
- cis-1,1,1,4,4,4-Hexafluoro-2-butene
- IUPAC
- (Z)-1,1,1,4,4,4-hexafluorobut-2-ene
- 現地名
- (Z)-1,1,1,4,4,4-ヘキサフルオロ-2-ブテン
- 英語名
- (Z)-1,1,1,4,4,4-HEXAFLUORO-2-BUTENE
- 分子式
- C4H2F6
- 分子量
- 164.05
名称と別名
名称をさらに表示
データベース識別子
- CAS
692-49-9- PubChem CID
- 52991879
- DTXSID
DTXSID00883476- EC Number
- 700-651-7
- Nikkaji
- J143.848D
物性
構造計算による物性
- XLogP
- 2.7
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 6
- 回転可能結合数
- 0
- 重原子数
- 10
- 形式電荷
- 0
- 複雑度
- 110
実験および物理化学的性質
物理化学的性質
- 沸点
- 9 ℃ · 9℃
- 比重(密度)
- 1.356 · 1.356
- 蒸気圧
- 60.435 kPa · 60.435kPa at 20.01℃
- 闪点
- -21 ℃ · -21℃
- 貯蔵温度
- Refrigerator
- 溶解性
- クロロホルム(少量)、メタノール(少量)
- 外見
- 油
- 色
- 無色
- 安定性
- 非常に揮発性
- InChI
- InChI=1S/C4H2F6/c5-3(6,7)1-2-4(8,9)10/h1-2H/b2-1-
- InChIKey
- NLOLSXYRJFEOTA-UPHRSURJSA-N
- SMILES
- C(F)(F)(F)/C=C\C(F)(F)F
- LogP
- 2.3 at · 2.3 at 30℃ and pH6.1
- EPAの化学物質情報
- 2 · 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)- (692-49-9)
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (106 of 106) of all reports.
Not Classified;Reported as not meeting GHS hazard criteria by 106 of 106 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 106 reports by companies from 2 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 106 of 106 reports by companies.;There are 0 notifications provided by 0 of 106 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
危険有害性情報
Regulatory Information
Chemical: 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)-;Specific Information Requirement: Obligations to provide information apply. These obligations are:;1. A person introducing this chemical must tell us in writing within 28 calendar days if any of the following circumstances have occurred in relation to their introduction (importation or manufacture):;a. The chemical is proposed to exceed 20% concentration in polyurethane foams (including spray polyurethane foams) for use in residential or commercial buildings.;2. A person who introduces this chemical must tell us in writing within 28 calendar days if they become aware of any of the following circumstances, namely, that since the assessment under the Industrial Chemicals (Notification and Assessment) Act 1989:;a. the function or use of the chemical has changed, or is likely to change, significantly;;b. the amount of the chemical being introduced has increased, or is likely to increase, significantly;;c. in the case of a chemical not manufactured, or proposed to be manufactured, in Australia at the time of the assessmentâit has begun to be manufactured in Australia;;d. the method of manufacture of the chemical in Australia has changed, or is likely to change, in a way that may result in an increased risk of an adverse effect of the chemical on occupational health and safety, public health or the environment;;e. additional information has become available to the person as to an adverse effect of the chemical on occupational health and safety, public health or the environment.
2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 27-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/10030
(Z)-1,1,1,4,4,4-Hexafluoro-2-butene: 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.
法規制情報
Regulatory Information
Chemical: 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)-;Specific Information Requirement: Obligations to provide information apply. These obligations are:;1. A person introducing this chemical must tell us in writing within 28 calendar days if any of the following circumstances have occurred in relation to their introduction (importation or manufacture):;a. The chemical is proposed to exceed 20% concentration in polyurethane foams (including spray polyurethane foams) for use in residential or commercial buildings.;2. A person who introduces this chemical must tell us in writing within 28 calendar days if they become aware of any of the following circumstances, namely, that since the assessment under the Industrial Chemicals (Notification and Assessment) Act 1989:;a. the function or use of the chemical has changed, or is likely to change, significantly;;b. the amount of the chemical being introduced has increased, or is likely to increase, significantly;;c. in the case of a chemical not manufactured, or proposed to be manufactured, in Australia at the time of the assessmentâit has begun to be manufactured in Australia;;d. the method of manufacture of the chemical in Australia has changed, or is likely to change, in a way that may result in an increased risk of an adverse effect of the chemical on occupational health and safety, public health or the environment;;e. additional information has become available to the person as to an adverse effect of the chemical on occupational health and safety, public health or the environment.
2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 27-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/10030
(Z)-1,1,1,4,4,4-Hexafluoro-2-butene: 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.
安全データ
- tsca
- TSCA listed
- 化審法
- 新規公示化学物質(2011年4月1日以降届出)
化学と産業
用途と製造
General Manufacturing Information
Construction;All Other Chemical Product and Preparation Manufacturing;Miscellaneous Manufacturing
2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)-: ACTIVE
応用分野
使用Z-1,1,1,4,4,4-Hexafluoro-2-butene is a useful compound in regards to heat transfer applications due to the stability of the carbon fluorine bond.
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