3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide

3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide 基本信息
CAS号 63886-40-8 分子式 C15H29IN2
分子量 364.30900 精确质量  364.13800
PSA  3.24000 LogP  -0.75050

基本信息 展开↓

CAS号:
63886-40-8
3D弹球模型:
立即前往扯扯看
分子式:
C15H29IN2
分子量:
364.30900
中文名称:
3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide
英文名称:
3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide
中文别名:
3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide
英文别名:
3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide
精确分子量/精确质量:
364.13800
极性分子表面积/PSA:
3.24000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: XSSPZLNOIOIIGS-UHFFFAOYSA-M

合成路线查看所有的合成路线

  • 100878-94-2

    100878-94-2

  • +

  • 74-88-4

    甲基碘

  • 63886-40-8

    3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide

  • 87942-52-7

    3-(2-chloroethyl)-3-azabicyclo[3.3.1]nonane

  • 63886-40-8

    3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane,iodide

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY2750000
CHEMICAL NAME :
Pyrrolidinium, 1-(2-(3-azabicyclo(3.3.1)non-3-yl)ethyl)-1-methyl-, iodide
CAS REGISTRY NUMBER :
63886-40-8
LAST UPDATED :
199109
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H29-N2.I
MOLECULAR WEIGHT :
364.36
WISWESSER LINE NOTATION :
T66 A DNTJ D2- AT5KTJ A1 &Q &I

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 14,544,1959

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  • 87942-52-7

    3-(2-chloroethyl)-3-azabicyclo[3.3.1]nonane

  • 100878-94-2

    N/A

  • 74-88-4

    甲基碘

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