Acetic acid 10-acetoxymethyl-anthracen-9-ylmethyl ester 分子结构式
HCID613145

Acetic acid 10-acetoxymethyl-anthracen-9-ylmethyl ester

[10-(acetyloxymethyl)anthracen-9-yl]methyl acetate

C20H18O4322.4 g/molCAS 10273-84-4

IDENTITY

结构与身份

标准SMILES
CC(=O)OCc1c2ccccc2c(COC(C)=O)c2ccccc12
InChIKey
BVPQUFPFMVPKTA-UHFFFAOYSA-N
分子式
C20H18O4
平均分子量
322.4 g/mol
单同位素质量
322.12050905

COMPUTED

结构计算性质

已同步
XLogP
3.8
极性表面积
52.6 Ų
氢键供体
0
氢键受体
4
可旋转键
6
重原子
24
形式电荷
0
复杂度
395

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P273, P391, 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

来源:PubChem
Hazard Classes and Categories

Aquatic Acute 1 (100%);Aquatic Chronic 1 (100%)

ALIASES

名称与别名

共 28 条
ACETIC ACID 10-ACETOXYMETHYL-ANTHRACEN-9-YLMETHYL ESTERRefChem:551884682-982-610273-84-4Anthracene-9,10-diylbis(methylene) diacetate[10-(acetyloxymethyl)anthracen-9-yl]methyl acetate(10-[(Acetyloxy)methyl]-9-anthryl)methyl acetate9,10-Anthracenedimethanol, 9,10-diacetate{10-[(acetyloxy)methyl]anthracen-9-yl}methyl acetateBIDD:GT0241SCHEMBL4647196SCHEMBL29853925DTXSID503465469,10-bis(acetoxymethyl)anthraceneMFCD00229356NSC8436959,10-Anthracenedimethanol, diacetateAKOS024331822HS-3284NSC-843695

REACTIONS

参与反应

222
HRID 1446 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05726124

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HRID 1505 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05726162

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HRID 2118 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05728698

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HRID 3668 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05734061

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HRID 3697 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05734081

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HRID 46561 反应方程式

uspto-grants-1979_11 · 10.6084/m9.figshare.5104873.v1 · US04173650

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HRID 46830 反应方程式

uspto-grants-1979_11 · 10.6084/m9.figshare.5104873.v1 · US04175189

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HRID 48533 反应方程式

uspto-grants-2004_03 · 10.6084/m9.figshare.5104873.v1 · US06703516B2

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