基本情報
- CAS
5285-60-9- 標準SMILES
CCC(C)Nc1ccc(Cc2ccc(NC(C)CC)cc2)cc1- InChIKey
YZZTZUHVGICSCS-UHFFFAOYSA-N- 分子式
- C21H30N2
- 平均分子量
- 310.5 g/mol
- 単同位体質量
- 310.24089897
名称と識別子
- 優先名称
- Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
- IUPAC
- N-butan-2-yl-4-[[4-(butan-2-ylamino)phenyl]methyl]aniline
- 現地名
- 4,4'-メチレンビス[N-(1-メチルプロピル)アニリン]
- 英語名
- 4,4'-methylenebis[N-sec-butylaniline]
- 分子式
- C21H30N2
- 分子量
- 310.48
名称と別名
5285-60-94,4'-Bis(sec-butylamino)diphenylmethaneEINECS 226-122-6Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-DTXSID9041499Benzenamine, 4,4'-methylenebis(N-(1-methylpropyl)-RefChem:117224DTXCID70214994,4'-Methylenebis(N-(sec-butyl)aniline)4,4'-Methylenebis(N-sec-butylaniline)4,4'-methylenebis[N-sec-butylaniline]N-butan-2-yl-4-[[4-(butan-2-ylamino)phenyl]methyl]aniline
名称をさらに表示
4,4'-メチレンビス[N-(1-メチルプロピル)ベンゼンアミン]4,4'-メチレンビス(N-sec-ブチルアニリン)4,4'-メチレンビス(N-sec-ブチルベンゼンアミン)4,4'-メチレンビス[N-(1-メチルプロピル)アニリン]4,4′-メチレンビス[N-(1-メチルプロピル)アニリン]4,4′-メチレンビス(N-sec-ブチルアニリン)4,4′-メチレンビス[N-(1-メチルプロピル)ベンゼンアミン]N-(ブタン-2-イル)-4-({4-[(ブタン-2-イル)アミノ]フェニル}メチル)アニリン4,4′-メチレンビス(N-sec-ブチルベンゼンアミン)MBDA4,4'-methylenebis[N-sec-butylanilineUnilink?4200ACETOSTAB 225POLYLINK 4200WANALINK? 6200N,N'-dibutyldiaminodiphenylmethane
物性
構造計算による物性
- XLogP
- 6.5
- 極性表面積
- 24.1 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 2
- 回転可能結合数
- 8
- 重原子数
- 23
- 形式電荷
- 0
- 複雑度
- 271
実験および物理化学的性質
Physical DescriptionCBI; Liquid
物理化学的性質
- 沸点
- 240 · 240-250 °C(Press: 2-3 Torr)
- 比重(密度)
- 1.009 · 1.009±0.06 g/cm3(Predicted)
- 蒸気圧
- 0 Pa · 0Pa at 25℃
- 貯蔵温度
- 2 · 2-8°C, protect from light
- 酸解離定数(Pka)
- 6.23 · 6.23±0.39(Predicted)
- 水溶解度
- 1.5 mg/L · 1.5mg/L at 20℃
- InChI
- InChI=1S/C21H30N2/c1-5-16(3)22-20-11-7-18(8-12-20)15-19-9-13-21(14-10-19)23-17(4)6-2/h7-14,16-17,22-23H,5-6,15H2,1-4H3
- InChIKey
- YZZTZUHVGICSCS-UHFFFAOYSA-N
- SMILES
- C(C1=CC=C(NC(C)CC)C=C1)C1=CC=C(NC(C)CC)C=C1
- LogP
- 5.4 at · 5.4 at 20℃
- EPAの化学物質情報
- 4 · 4,4'-Methylenebis(N-sec-butylaniline) (5285-60-9)
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 2.2% (6 of 279) of reports.
Warning
H302 (97.8%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P319, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 279 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)- 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)
REACH registered substance: 4,4'-methylenebis[N-sec-butylaniline] (EC: 226-122-6)
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-: 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.
Hazard Classes and CategoriesAcute Tox. 4 (97.8%)
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Not Known or Reasonably Ascertainable
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-: ACTIVE
応用分野
使用4,4'-methylenebis(N-sec-butylaniline) be used as epoxy curing agents.
サプライヤー100 社
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
山东海舟生物工程有限公司130-0567-0367 13006570367 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
関連反応
3 件
化合物ノート
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