基本情報
- CAS
2162-74-5- 標準SMILES
CC(C)c1cccc(C(C)C)c1N=C=Nc1c(C(C)C)cccc1C(C)C- InChIKey
XLDBGFGREOMWSL-UHFFFAOYSA-N- 分子式
- C25H34N2
- 平均分子量
- 362.5 g/mol
- 単同位体質量
- 362.27219909
名称と識別子
- 優先名称
- Bis(2,6-diisopropylphenyl)carbodiimide
- IUPAC
- N,N'-bis[2,6-di(propan-2-yl)phenyl]methanediimine
- 現地名
- ビス(2,6-ジイソプロピルフェニル)カルボジイミド
- 英語名
- Bis(2,6-diisopropylphenyl)carbodiimide
- 分子式
- C25H34N2
- 分子量
- 362.56
名称と別名
Bis(2,6-diisopropylphenyl)carbodiimideStaboxol 1Carbo DYPK27Z98PLDTXSID50518622,2',6,6'-TetraisopropyldiphenylcarbodiimideEINECS 218-487-5Benzenamine, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)-UNII-YPK27Z98PLCarbodiimide, bis(2,6-diisopropylphenyl)-N,N'-Methanetetraylbis(2,6-bis(1-methylethyl)benzenamine)Benzenamine, N,N'-methanetetraylbis(2,6-bis(1-methylethyl)-
名称をさらに表示
ビス(2,6-ジイソプロピルフェニル)カルボジイミドN,N'-ビス(2,6-ジイソプロピルフェニル)カルボジイミドビス-(2,6-ジイソプロピルフェニル)カルボジイミドN，N’-ビス（2，6-ジイソプロピルフェニル）カルボジイミドビス[(2,6-ジイソプロピルフェニル)イミノ]メタンN,N'-ビス[2,6-ビス(プロパン-2-イル)フェニル]メタンジイミンN,N′-ビス(2,6-ジイソプロピルフェニル)メタンジイミンN,N′-ビス(2,6-ジイソプロピルフェニル)カルボジイミド1,3-ビス(2,6-ジイソプロピルフェニル)カルボジイミドN,N'-Bis(2,6-diisopropylphenyl)carbodiimideStabilizer 7000Bis(2,6-diisopropylphenyl)carbodiimide ,98%DIPPCcarbodHS-700FStaboxolstaboxol1
物性
構造計算による物性
- XLogP
- 9.1
- 極性表面積
- 24.7 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 2
- 回転可能結合数
- 6
- 重原子数
- 27
- 形式電荷
- 0
- 複雑度
- 419
実験および物理化学的性質
Physical DescriptionOther Solid; Large Crystals; Other Solid
Collision Cross Section189.6 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID5051862]
物理化学的性質
- 融点
- 51 °C · 51 °C
- 沸点
- 152 · 152-162 °C(Press: 0.05 Torr)
- 比重(密度)
- 0.95 · 0.95±0.1 g/cm3(Predicted)
- 蒸気圧
- 0.006 Pa · 0.006Pa at 20℃
- 闪点
- 197 ℃ · 197℃
- 貯蔵温度
- 2 · 2-8°C
- 外見
- powder to lump
- 色
- White to Almost white
- 水溶解度
- 50 μg/L · 50μg/L at 20℃
- InChI
- InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3
- InChIKey
- XLDBGFGREOMWSL-UHFFFAOYSA-N
- SMILES
- N(C1C(=CC=CC=1C(C)C)C(C)C)=C=NC1C(=CC=CC=1C(C)C)C(C)C
- LogP
- 6.2 at · 6.2 at 30℃
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 0.1% (1 of 684) of reports.
Danger
H302 (98%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P264, P270, P280, P301+P317, P318, P319, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 684 reports by companies from 15 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, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)-
Regulation (EC) No 1935/2004 (amended)
Benzenamine, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)- 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: Bis(2,6-diisopropylphenyl)carbodiimide (EC: 218-487-5)
Benzenamine, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (98%)
安全データ
- tsca
- TSCA listed
- rtecs
- CY0887250
- ridadr
- 2811
- 毒性
- LD50 orl-rat: 200 mg/kg NTIS** OTS0545280
- hs_code
- 29213000
- risk_code
- 36/37/38
- 化審法
- (3)-142
- safety_code
化学と産業
用途と製造
U.S. Production2023: 75,000 - <500,000 lb
Consumer UsesPlasticizer
Industry UsesOther
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Benzenamine, N,N'-methanetetraylbis[2,6-bis(1-methylethyl)-: ACTIVE
応用分野
用途有機合成原料。
上流・下流製品情報
上流原料
下流製品
サプライヤー100 社
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
関連反応
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化合物ノート
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