基本信息
- 标准SMILES
Cl.NN1CC2CCCC2C1- InChIKey
WPYNXKFLSQEEFE-UHFFFAOYSA-N- 分子式
- C7H15ClN2
- 平均分子量
- 162.66 g/mol
- 单同位素质量
- 162.0923762
名称与标识
- 首选名称
- Hexahydrocyclopenta(c)pyrrol-2(1H)-amine monohydrochloride
- IUPAC
- 3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-amine;hydrochloride
- 中文名
- N-氨基-3-氮杂双环[3.3.0]辛烷盐酸盐
- 英文名
- 3-Amino-3-azabicyclo[3.3.0]octane hydrochloride
- 分子式
- C7H15ClN2
- 分子量
- 162.66
名称与别名
展开更多名称
数据库标识
- CAS
58108-05-7- PubChem CID
- 16213802
- DTXSID
DTXSID40973688- EC Number
- 261-131-9
性质
结构计算性质
- 极性表面积
- 29.3 Ų
- 氢键供体
- 2
- 氢键受体
- 2
- 可旋转键
- 0
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 101
物理化学性质
- 熔点
- 170 · 170-174 °C(lit.)
- 储存条件
- Inert atmosphere,Room Temperature
- 溶解度
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly),Water (Slightly)
- 形态
- Solid
- 颜色
- Off-White to Pale Beige
- 稳定性
- Hygroscopic
- InChI
- InChI=1S/C7H14N2.ClH/c8-9-4-6-2-1-3-7(6)5-9;/h6-7H,1-5,8H2;1H
- InChIKey
- WPYNXKFLSQEEFE-UHFFFAOYSA-N
- SMILES
- NN1CC2CCCC2C1.Cl
- CAS 数据库
- 58108 · 58108-05-7(CAS DataBase Reference)
安全与法规
GHS分类
GHS Classification
This chemical does not meet GHS hazard criteria for 2.2% (1 of 46) of reports.
Warning
H315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (97.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (97.8%): 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 46 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 46 reports by companies.;There are 6 notifications provided by 45 of 46 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.
危害信息
法规信息
安全数据
- wgk
- 3
- 存储类别
- 11 - Combustible Solids
- 安全说明
- 26-36
- 危险品标志
- Xi
- 危险性类别
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 危险类别码
- 36/37/38
化学与工业
应用领域
用途N-氨基-3-氮杂双环[3.3.0]辛烷盐酸盐用作磺酰脲降血糖药格列齐特的合成反应物。 用作抗糖尿病药。
用途用作药物格列齐特中间体;Glicianide intermediate格列奇特中间体;
上下游产品信息
上游原料
下游产品
试剂价格
- XW025810805702 · 500g
- 3-氨基-3-氮杂双环[3.3.0]辛烷 盐酸盐Hexahydrocyclopenta[c]pyrrol-2(1H)-amine hydrochloride — 1350元
- XW025810805701 · 100g
- 3-氨基-3-氮杂双环[3.3.0]辛烷 盐酸盐Hexahydrocyclopenta[c]pyrrol-2(1H)-amine hydrochloride — 271元
供应商50 家
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