Methyl cumyl ether 分子结构式
HCID70289

Methyl cumyl ether

2-methoxypropan-2-ylbenzene

C10H14O150.22 g/molCAS 935-67-1

IDENTITY

结构与身份

标准SMILES
COC(C)(C)c1ccccc1
InChIKey
MRFQFQYRTNGOCZ-UHFFFAOYSA-N
分子式
C10H14O
平均分子量
150.22 g/mol
单同位素质量
150.10446507

COMPUTED

结构计算性质

已同步
XLogP
3.1
极性表面积
9.2 Ų
氢键供体
0
氢键受体
1
可旋转键
2
重原子
11
形式电荷
0
复杂度
112

GHS

GHS分类

GHS Classification

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 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

Hazard Classes and Categories

Acute Tox. 4 (100%);Eye Dam. 1 (100%)

USES

用途与制造

General Manufacturing Information

Benzene, (1-methoxy-1-methylethyl)-: INACTIVE

ALIASES

名称与别名

共 29 条
Methyl cumyl ether(1-Methoxy-1-methylethyl)benzene2-Methoxy-2-phenylpropaneBenzene, (1-methoxy-1-methylethyl)-Methyl alpha,alpha-dimethylbenzyl etherEINECS 213-306-6alpha,alpha-Dimethylbenzyl methyl etherDTXSID6061319Ether, .alpha.,.alpha.-dimethylbenzyl methyl.alpha.,.alpha.-Dimethylbenzyl methyl etherRefChem:157826DTXCID2048870Ether, alpha,alpha-dimethylbenzyl methyl213-306-6MRFQFQYRTNGOCZ-UHFFFAOYSA-N935-67-12-methoxypropan-2-ylbenzene(2-methoxypropan-2-yl)benzenecumyl methyl etherSCHEMBL42639

REACTIONS

相关反应

2
HRID 156286 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID 1758583 反应方程式

uspto-grants-1983_02 · 10.6084/m9.figshare.5104873.v1 · US04374279

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