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基本情報
- CAS
1742-14-9- 標準SMILES
Cc1ccc(C(C)c2ccc(C)c(C)c2)cc1C- InChIKey
NCSVCMFDHINRJE-UHFFFAOYSA-N- 分子式
- C18H22
- 平均分子量
- 238.4 g/mol
- 単同位体質量
- 238.1721507
名称と識別子
- 優先名称
- 1,1-Bis(3,4-dimethylphenyl)ethane
- IUPAC
- 4-[1-(3,4-dimethylphenyl)ethyl]-1,2-dimethylbenzene
- 現地名
- 1,1-ビス(3,4-ジメチルフェニル)エタン
- 英語名
- 1,1-Bis(3,4-dimethylphenyl)ethane
- 分子式
- C18H22
- 分子量
- 238.37
名称と別名
1,1-Bis(3,4-dimethylphenyl)ethane4,4'-(Ethane-1,1-diyl)bis(1,2-dimethylbenzene)Benzene, 1,1'-ethylidenebis[3,4-dimethyl-Ethane, 1,1-di-3,4-xylyl-1,1-Di-3,4-xylylethane4-[1-(3,4-Dimethylphenyl)ethyl]-1,2-dimethylbenzeneDTXSID9029223EINECS 217-108-0Benzene, 1,1'-ethylidenebis(3,4-dimethyl-UNII-K2ND496F5PK2ND496F5PJ99.764A
名称をさらに表示
1,1-ビス(3,4-ジメチルフェニル)エタン1,1-ジ(3,4-キシリル)エタン1,1'-エチリデンビス(3,4-ジメチルベンゼン)1,1-Di-(o-xyly)ethane1,1-DI(3,4-XYLYL)ETHANE3,3’,4,4’-Tetramethyldiphenylethane1,1-Bis(3,4-dimethylphenyl)ethane>1,1-BIS(3,4-DIMETHYLPHENYL)ETHANE 90+%1,1’-ethylidenebis[3,4-dimethyl-benzen1,1’-ethylidenebis(3,4-dimethyl-Benzene
DTXCID109223alpha-(3,4-Dimethylphenyl)-alpha-methyl-3,4-dimethyltolueneBenzene, 1,1'-ethylidenebis*3,4-dimethyl-1,1'-ETHYLIDENEBIS(3,4-DIMETHYLBENZENE)1,1'-(1,1-ETHANEDIYL)BIS(3,4-DIMETHYLBENZENE)4-(1-(3,4-DIMETHYLPHENYL)ETHYL)-1,2-DIMETHYLBENZENE1,1-Bis[3,4-dimethylphenyl]ethane.ALPHA.-(3,4-DIMETHYLPHENYL)-.ALPHA.-METHYL-3,4-DIMETHYLTOLUENE
データベース識別子
- CAS
1742-14-9- PubChem CID
- 74448
- DTXSID
DTXSID9029223- ChEMBL
CHEMBL3188142- UNII
- K2ND496F5P
- EC Number
- 217-108-0
- Nikkaji
- J99.764A
物性
構造計算による物性補完中
- XLogP
- 5.6
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 0
- 回転可能結合数
- 2
- 重原子数
- 18
- 形式電荷
- 0
- 複雑度
- 231
実験および物理化学的性質
Physical DescriptionLiquid
物理化学的性質
- 沸点
- 333 °C · 333 °C
- 比重(密度)
- 0.98 · 0.98
- 屈折率
- 20 · n20/D 1.564(lit.)
- 闪点
- 163 °C · 163 °C
- 貯蔵温度
- 2 · 2-8°C
- Henry's Law Constant
- 1 · 1.0×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010)
- NISTの化学物質情報
- 1 · Benzene, 1,1'-ethylidenebis[3,4-dimethyl-(1742-14-9)
- EPAの化学物質情報
- 1 · 1,1-Bis[3,4-dimethylphenyl]ethane (1742-14-9)
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 100% (4 of 4) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 4 of 4 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 4 of 4 reports by companies.；There are 0 notifications provided by 0 of 4 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: Benzene, 1,1'-ethylidenebis[3,4-dimethyl-
Benzene, 1,1'-ethylidenebis[3,4-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzene, 1,1'-ethylidenebis[3,4-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)
Hazard Classes and CategoriesNot Classified
法規制情報
Regulatory Information
Chemical: Benzene, 1,1'-ethylidenebis[3,4-dimethyl-
Benzene, 1,1'-ethylidenebis[3,4-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzene, 1,1'-ethylidenebis[3,4-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)
化学と産業
用途と製造
U.S. Production2023: 1,000,000 - <5,000,000 lb；2022: 1,000,000 - <5,000,000 lb；2021: 1,000,000 - <5,000,000 lb；2020: 1,000,000 - <5,000,000 lb
Industry UsesIntermediate
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Benzene, 1,1'-ethylidenebis[3,4-dimethyl-: ACTIVE
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