HRID126151
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
作为生成物
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- CC(C)(C)OC(=O)N1CCNCC1
- InChIKey
- CWXPZXBSDSIRCS-UHFFFAOYSA-N
- 分子式
- C9H18N2O2
- 平均分子量
- 186.25 g/mol
- 单同位素质量
- 186.13682782
COMPUTED
结构计算性质
- XLogP
- 0.5
- 极性表面积
- 41.6 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 2
- 重原子
- 13
- 形式电荷
- 0
- 复杂度
- 181
GHS
GHS 分类
GHS Classification
This chemical does not meet GHS hazard criteria for 14.1% (10 of 71) of reports.
Warning
H315 (76.1%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (73.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (74.6%): 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 71 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 10 of 71 reports by companies.；There are 14 notifications provided by 61 of 71 reports by companies with hazard statement code(s).；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
Regulatory Information
Status: Active Update: 27-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/17850；Status: Active Update: 18-09-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16530；Status: Active Update: 30-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/6089
Hazard Classes and Categories
Skin Irrit. 2 (76.1%)；Eye Irrit. 2 (73.2%)；STOT SE 3 (74.6%)
REGULATORY
法规信息
Regulatory Information
Status: Active Update: 27-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/17850；Status: Active Update: 18-09-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16530；Status: Active Update: 30-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/6089
ALIASES
名称与别名
1-Boc-piperazine57260-71-6tert-butyl piperazine-1-carboxylateN-Boc-piperazine1-(tert-Butoxycarbonyl)piperazineN-t-Butoxycarbonylpiperazine1-piperazinecarboxylic acid, 1,1-dimethylethyl estert-butyl piperazine-1-carboxylateLBC2X3S28CDTXSID30205884EC 611-489-0RefChem:896481DTXCID60128375611-489-0InChI=1/C9H18N2O2/c1-9(2,3)13-8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3Htert-Butyl 1-piperazinecarboxylate1-N-Boc-piperazineMFCD00075265piperazine-1-carboxylic acid tert-butyl esterN-tert-butoxycarbonylpiperazine
REACTIONS
参与反应
HRID159891
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为生成物、反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看条件与参与物HRID392383
uspto-grants-2004_10
作为生成物
uspto-grants-2004_10 · 10.6084/m9.figshare.5104873.v1 · US06800646B1
查看条件与参与物HRID565200
uspto-grants-2001_01
作为生成物
uspto-grants-2001_01 · 10.6084/m9.figshare.5104873.v1 · US06172062B2
查看条件与参与物HRID565201
uspto-grants-2001_01
作为生成物
uspto-grants-2001_01 · 10.6084/m9.figshare.5104873.v1 · US06172062B2
查看条件与参与物HRID842249
uspto-grants-2002_04
作为生成物
uspto-grants-2002_04 · 10.6084/m9.figshare.5104873.v1 · US06372758B1
查看条件与参与物HRID891049
uspto-grants-2006_02
作为生成物、反应物
uspto-grants-2006_02 · 10.6084/m9.figshare.5104873.v1 · US07001909B2
查看条件与参与物HRID1279249
uspto-grants-2002_09
作为生成物
uspto-grants-2002_09 · 10.6084/m9.figshare.5104873.v1 · US06448250B1
查看条件与参与物