HCID2808992

Ethyl 3,4-bis(2-methoxyethoxy)benzoate

C15H22O6298.33 g/molCAS 183322-16-9

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)c1ccc(OCCOC)c(OCCOC)c1
InChIKey: VGFZRAVMWXHEJB-UHFFFAOYSA-N
分子式: C15H22O6
平均分子量: 298.33 g/mol
单同位素质量: 298.14163842

COMPUTED

结构计算性质

已同步

XLogP: 2
极性表面积: 63.2 Å²
氢键供体: 0
氢键受体: 6
可旋转键: 11
重原子: 21
形式电荷: 0
复杂度: 283

GHS

GHS分类

来源：PubChem

GHS Classification

Not Classified；Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

HAZARDS

危害信息

来源：PubChem

Regulatory Information

Status: Cease Manufacture Update: 06-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6953

Hazard Classes and Categories

Not Classified

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Status: Cease Manufacture Update: 06-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6953

ALIASES

名称与别名

共 31 条

ethyl 3,4-bis(2-methoxyethoxy)benzoate183322-16-9Benzoic acid, 3,4-bis(2-methoxyethoxy)-, ethyl esterDTXSID40384593EC 605-991-9RefChem:138644DTXCID50335617605-991-93,4-Bis(2-methoxyethoxy)benzoic acid ethyl esterMFCD01935284C15H22O6Erlotinib Impurity 118PDJ499URB3SCHEMBL263238VGFZRAVMWXHEJB-UHFFFAOYSA-NCCG-41047AKOS000282910AC-8521FD16016IB31255

REACTIONS

参与反应

9 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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uspto-grants-2016_04 · 10.6084/m9.figshare.5104873.v1 · US09320739B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08969587B2

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uspto-grants-2012_03 · 10.6084/m9.figshare.5104873.v1 · US08133999B2

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uspto-grants-2012_03 · 10.6084/m9.figshare.5104873.v1 · US08134015B2

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uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08618289B2

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