结构:COc1ccc(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C(C)(C)C)C(C)(C)C
HCID56641709

(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)[bis(2-methyl-2-propanyl)]phosphine

ditert-butyl-[6-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane

C31H49OP468.7 g/molCAS 1262046-34-3

IDENTITY

结构与身份

标准 SMILES
COc1ccc(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C(C)(C)C)C(C)(C)C
InChIKey
CVLLAKCGAFNZHJ-UHFFFAOYSA-N
分子式
C31H49OP
平均分子量
468.7 g/mol
单同位素质量
468.35210318

COMPUTED

结构计算性质

已同步
XLogP
8.8
极性表面积
9.2 Ų
氢键供体
0
氢键受体
1
可旋转键
8
重原子
33
形式电荷
0
复杂度
563

GHS

GHS 分类

来源:PubChem
GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;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.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Skin Irrit. 2 (100%);Eye Irrit. 2 (100%)

ALIASES

名称与别名

38
1262046-34-3(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)(bis(2-methyl-2-propanyl))phosphine(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)[bis(2-methyl-2-propanyl)]phosphineRefChem:394269805-149-2RockPhosDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-[1,1'-biphenyl]-2-yl)phosphineMFCD20922895RockpahosPhosphine, bis(1,1-dimethylethyl)[3-methoxy-6-methyl-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl]-ditert-butyl-[6-methoxy-3-methyl-2-(2,4,6-triisopropylphenyl)phenyl]phosphaneditert-butyl-[6-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane2-Di-tert-butylphosphino-3-methoxy-6-methyl-2'-4'-6'-triisopropylbiphenyl2-Di-tert-butylphosphino-3-Methoxy-6-Methyl-2',4',6'-triisopropyl-1,1'-biphenylDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-2-biphenylyl)phosphine2-(Di-t-butylphosphino)-3-methoxy-6-methyl-2',4',6'-tri-i-propyl-1,1'-biphenylDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-[1,1'-biphenyl]-2-yl)phosphine;2-Di-tert-butylphosphino-3-Methoxy-6-Methyl-2',4',6'-triisopropyl-1,1'-biphenylRockPhos, 97%Di-tert-butyl(2 inverted exclamation marka,4 inverted exclamation marka,6 inverted exclamation marka-triisopropyl-3-methoxy-6-methyl-[1,1 inverted exclamation marka-biphenyl]-2-yl)phosphineC31H49OP

REACTIONS

参与反应

557
HRID1301808

High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions

作为催化剂
HRID 1301808 方程式

High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions · 10.1021/jacs.6c05959

查看条件与参与物
HRID1301809

High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions

作为催化剂
HRID 1301809 方程式

High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions · 10.1021/jacs.6c05959

查看条件与参与物