HCID153296

Oxiranemethanol, 4-methylbenzenesulfonate, (S)-

[(2S)-oxiran-2-yl]methyl 4-methylbenzenesulfonate

C10H12O4S228.27 g/molCAS 70987-78-9

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(S(=O)(=O)OC[C@@H]2CO2)cc1
InChIKey: NOQXXYIGRPAZJC-VIFPVBQESA-N
分子式: C10H12O4S
平均分子量: 228.27 g/mol
单同位素质量: 228.04563003

COMPUTED

结构计算性质

已同步

XLogP: 1.1
极性表面积: 64.3 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 4
重原子: 15
形式电荷: 0
复杂度: 298

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]；H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]；H341: Suspected of causing genetic defects [Warning Germ cell mutagenicity]；H350: May cause cancer [Danger Carcinogenicity]；H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P203, P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P318, P321, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Danger

HAZARDS

危害信息

来源：PubChem

Regulatory Information

Hazard Traits - Carcinogenicity；Authoritative List - EC Annex VI CMRs - Cat. 1B；Report - if used as a fragrance or flavor ingredient

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2748

Hazard Classes and Categories

Skin Sens. 1 (66.7%)；Eye Dam. 1 (66.7%)；Muta. 2 (66.7%)；Carc. 1B (66.7%)；Aquatic Chronic 2 (66.7%)

Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；Muta. 2 (100%)；Carc. 1B (100%)；Aquatic Chronic 2 (100%)

Carcinogenicity - category 1B；Germ cell mutagenicity - category 2；Eye damage - category 1；Skin sensitisation - category 1；Hazardous to the aquatic environment (chronic) - category 2

Germ cell mutagenicity - Category 2

Carc. 1B；Muta. 2；Eye Dam. 1；Skin Sens. 1；Aquatic Chronic 2

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Hazard Traits - Carcinogenicity；Authoritative List - EC Annex VI CMRs - Cat. 1B；Report - if used as a fragrance or flavor ingredient

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2748

ALIASES

名称与别名

共 61 条

(S)-Glycidyl tosylateCCRIS 6400BRN 3592143Oxiranemethanol, 4-methylbenzenesulfonate, (S)-EC 417-210-7oxiranemethanol, 4-methylbenzene-sulfonate, (S)-(2S)-(+)-Glycidyl p-ToluenesulfonateRefChem:857750417-210-7627-364-970987-78-9(2S)-(+)-Glycidyl tosylate(S)-(+)-Oxirane-2-methanol p-toluenesulfonate(+)-Glycidyl tosylate[(2S)-oxiran-2-yl]methyl 4-methylbenzenesulfonateMFCD00064489(2S)-Glycidyl tosylate(2S)-Oxiran-2-ylmethyl 4-methylbenzenesulfonate(2S)-(+)-Glycidyltosylate(S)-Glycidyltosylate

REACTIONS

参与反应

31 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07745438B2

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uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07745438B2

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uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524766B2

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uspto-grants-2004_03 · 10.6084/m9.figshare.5104873.v1 · US06699860B2

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uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440958B2

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uspto-grants-1996_06 · 10.6084/m9.figshare.5104873.v1 · US05530011

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uspto-grants-2013_02 · 10.6084/m9.figshare.5104873.v1 · US08372981B2

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uspto-grants-2003_08 · 10.6084/m9.figshare.5104873.v1 · US06605618B2

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