HCID83168

Carbonic acid, 1,1-dimethylethyl 2,5-dioxo-1-pyrrolidinyl ester

tert-butyl (2,5-dioxopyrrolidin-1-yl) carbonate

C9H13NO5215.2 g/molCAS 13139-12-3

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)OC(=O)ON1C(=O)CCC1=O
InChIKey: VTGFSVGZCYYHLO-UHFFFAOYSA-N
分子式: C9H13NO5
平均分子量: 215.2 g/mol
单同位素质量: 215.07937252

COMPUTED

结构计算性质

已同步

XLogP: 0.6
极性表面积: 72.9 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 4
重原子: 15
形式电荷: 0
复杂度: 288

GHS

GHS分类

GHS Classification

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 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

Hazard Classes and Categories

Acute Tox. 4 (100%)；Skin Sens. 1 (100%)

USES

用途与制造

General Manufacturing Information

Carbonic acid, 1,1-dimethylethyl 2,5-dioxo-1-pyrrolidinyl ester: INACTIVE

ALIASES

名称与别名

共 35 条

13139-12-3tert-Butyl N-succinimidyl carbonateCarbonic acid, 1,1-dimethylethyl 2,5-dioxo-1-pyrrolidinyl ester2,5-Pyrrolidinedione, 1-[[(1,1-dimethylethoxy)carbonyl]oxy]-EINECS 236-071-1DTXSID40653612,5-Pyrrolidinedione, 1-(((1,1-dimethylethoxy)carbonyl)oxy)-RefChem:123580DTXCID7034042Boc-OSutert-butyl (2,5-dioxopyrrolidin-1-yl) carbonateN-(tert-Butoxycarbonyloxy)succinimidetert-butyl 2,5-dioxopyrrolidin-1-yl carbonateMFCD00037903tert-Butyl succinimido carbonate2,5-dioxoazolidinyl (tert-butoxy)formate1-[(tert-butoxycarbonyl)oxy]pyrrolidine-2,5-dioneRJ8UGW9ZA6BOC-OSU, tert-Butyl N-succinimidyl carbonatetert-Butyl(2,5-dioxopyrrolidin-1-yl)carbonate

REACTIONS

相关反应

17 条

uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07423061B2

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uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434763B2

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09173883B2

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uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09173883B2

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uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08987457B2

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uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08987457B2

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uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08987457B2

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