1,9-bis({bicyclo[2.2.1]hept-5-en-2-yl})-3,3,5,5,7,7-hexamethyl-4,6-dioxa-3,5,7-trisilanonane

• ChemBase编号: 138647
• 分子式: C24H44O2Si3
• 平均质量: 448.86146
• 单一同位素质量: 448.26491024
• SMILES: C[Si](C)(CCC1CC2CC1C=C2)O[Si](C)(C)O[Si](C)(C)CCC1CC2CC1C=C2
• Canonical SMILES: C[Si](O[Si](CCC1CC2CC1C=C2)(C)C)(O[Si](CCC1CC2CC1C=C2)(C)C)C
• InChI: InChI=1S/C24H44O2Si3/c1-27(2,13-11-23-17-19-7-9-21(23)15-19)25-29(5,6)26-28(3,4)14-12-24-18-20-8-10-22(24)16-20/h7-10,19-24H,11-18H2,1-6H3
• InChIKey: OJLPCKNKLYMMBA-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,9-bis({bicyclo[2.2.1]hept-5-en-2-yl})-3,3,5,5,7,7-hexamethyl-4,6-dioxa-3,5,7-trisilanonane
• IUPAC传统名: 1,9-bis({bicyclo[2.2.1]hept-5-en-2-yl})-3,3,5,5,7,7-hexamethyl-4,6-dioxa-3,5,7-trisilanonane
• 别名: 1,1,3,3,5,5-六甲基-1,5-二[2-(5-降冰片烯)乙基]三硅氧烷; 1,1,3,3,5,5-Hexamethyl-1,5-bis[2-(5-norbornen-2-yl)ethyl]trisiloxane

登记号

• CAS号: 307496-39-5
• MDL号: MFCD02093769
• PubChem SID: 162232898; 24874347
• PubChem CID: 4149499

理论计算性质

• 质子受体: 2
• 质子供体: 0
• LogD (pH = 5.5): 6.5956
• LogD (pH = 7.4): 6.5956
• Log P: 6.5956
• 摩尔折射率: 117.684 cm^3
• 极化性: 51.718525 Å^3
• 极化表面积: 18.46 Å^2
• 可自由旋转的化学键: 10
• 里宾斯基五规则: false

分子性质

理化性质

• 闪点: 110 °C; 230 °F
• 密度: 0.976 g/mL at 25 °C(lit.)
• 折射率: n20/D 1.4690(lit.)

安全信息

• 德国WGK号: 3
• 个人保护装置: Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)

产品相关信息

• Empirical Formula (Hill Notation): C24H44O2Si3