HCID70216

Diethyl 2,2'-thiodiacetate

ethyl 2-(2-ethoxy-2-oxoethyl)sulfanylacetate

C8H14O4S206.26 g/molCAS 925-47-3

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)CSCC(=O)OCC
InChIKey: TVCSSJHLVLMADJ-UHFFFAOYSA-N
分子式: C8H14O4S
平均分子量: 206.26 g/mol
单同位素质量: 206.0612801

COMPUTED

结构计算性质

已同步

XLogP: 1.5
极性表面积: 77.9 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 8
重原子: 13
形式电荷: 0
复杂度: 152

GHS

GHS分类

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 (100%): 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 39 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

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

USES

用途与制造

Use Classification

Fragrance Ingredients

ALIASES

名称与别名

共 39 条

Diethyl 2,2'-thiodiacetateEINECS 213-117-9DTXSID50239020NSC 12576RefChem:587063DTXCID70161511213-117-9925-47-3Diethyl thioglycolatediethyl thiodiglycolateDIETHYL 2,2-THIODIACETATEethyl 2-(2-ethoxy-2-oxoethyl)sulfanylacetateMFCD00087932Diethyl 2,2'-ThiodiglycolateEthoxycarbonylmethylsulfanyl-acetic acid ethyl ester38N3YM4LAKNSC-12576diethyl 2,2'-sulfanediyldiacetateAcetic acid, 2,2'-thiobis-, diethyl ester3-Thiaglutaric acid diethyl ester

REACTIONS