2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester

HCID 15838007
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基本情報

CAS
103637-48-5
標準SMILES
C=C(C)C(=O)OC(COc1ccc(C(=O)c2ccccc2)c(O)c1)COc1ccc(C(=O)c2ccccc2)c(O)c1
InChIKey
RXULRQCENNCUGC-UHFFFAOYSA-N
分子式
C33H28O8
平均分子量
552.6 g/mol
単同位体質量
552.17841785

名称と識別子

優先名称
2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester
IUPAC
1,3-bis(4-benzoyl-3-hydroxyphenoxy)propan-2-yl 2-methylprop-2-enoate
英語名
1,3-Bis(4-benzoyl-3-hydroxyphenoxy)-2-propyl methacrylate
分子式
C33H28O8
分子量
552.57

名称と別名

103637-48-5DTXSID70730182-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-((4-benzoyl-3-hydroxyphenoxy)methyl)ethyl esterRefChem:479539DTXCID40328211,3-BIS(4-BENZOYL-3-HYDROXYPHENOXY)-2-PROPYL METHACRYLATE1,3-bis(4-benzoyl-3-hydroxyphenoxy)propan-2-yl 2-methylprop-2-enoate1,3-Bis(4-benzoyl-3-hydroxyphenoxy)propan-2-yl methacrylateSCHEMBL20183131,3-Bis(4-benzoyl-3-hydroxyphenoxy)propan-2-ylmethacrylate1,3-bis-(4-benzoyl-3-hydroxyphenoxy)2-propyl methacrylate
名称をさらに表示
(1,3-Bis[benzoly-3-hydroxyphenoxy]-2-propylmethacrylate)1,3-Bis(4-benzoyl-3-hydroxyphenoxy)prop-2-yl methacrylate2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-(4-benzoyl-3-hydroxyphenoxy)methylethyl ester
1,3-bis-(4-benzoyl-3-hydroxyphenoxy)-prop-2-yl methacrylate

データベース識別子

CAS
103637-48-5
PubChem CID
15838007
DTXSID
DTXSID7073018

物性

構造計算による物性

XLogP
7.6
極性表面積
119 Ų
水素結合供与体数
2
水素結合受容体数
8
回転可能結合数
13
重原子数
41

物理化学的性質

沸点
740.1 · 740.1±60.0 °C(Predicted)
比重(密度)
1.276 · 1.276±0.06 g/cm3(Predicted)
酸解離定数(Pka)
7.15 · 7.15±0.35(Predicted)
EPAの化学物質情報
2 · 2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester (103637-48-5)

安全と法規制

危険有害性情報

Regulatory Information · 2 件

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

法規制情報

Regulatory Information · 2 件

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

安全データ

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing Information2-Propenoic acid, 2-methyl-, 2-(4-benzoyl-3-hydroxyphenoxy)-1-[(4-benzoyl-3-hydroxyphenoxy)methyl]ethyl ester: INACTIVE

サプライヤー6 社

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]

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