鸭嘴花碱盐酸盐

鸭嘴花碱盐酸盐 基本信息
CAS号 7174-27-8 分子式 C11H13ClN2O
分子量 224.68700 精确质量  224.07200
PSA  35.83000 LogP  1.47230

基本信息 展开↓

CAS号:
7174-27-8
3D弹球模型:
立即前往扯扯看
分子式:
C11H13ClN2O
分子量:
224.68700
中文名称:
鸭嘴花碱盐酸盐
英文名称:
(3S)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol,hydrochloride
中文别名:
鸭嘴花碱盐酸盐
英文别名:
(3S)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol,hydrochloride;
Peganine monohydrochloride;
linarinehydrochloride;
Vasicine Hcl
精确分子量/精确质量:
224.07200
极性分子表面积/PSA:
35.83000
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: CSDQSAHJCAKJPT-UHFFFAOYSA-N

物化性质展开↓

熔点:
206-208ºC
沸点:
373.8ºC at 760 mmHg
闪点:
179.9ºC

合成路线查看所有的合成路线

  • 6159-56-4

    1,2,3,9-四氢吡咯并[2,1-B]喹唑啉-3-醇

  • 7174-27-8

    鸭嘴花碱盐酸盐

  • 158734-31-7

    Vasicol

  • 7174-27-8

    鸭嘴花碱盐酸盐

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY9454100
CHEMICAL NAME :
Pyrrolo(2,1-b)quinazolin-3-ol, 1,2,3,9-tetrahydro-, monohydrochloride, (R)-
CAS REGISTRY NUMBER :
7174-27-8
LAST UPDATED :
199510
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C11-H12-N2-O.Cl-H
MOLECULAR WEIGHT :
224.71

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
640 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 13,474,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
115 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 13,474,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
335 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 13,474,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
290 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 13,474,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 13,474,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
78200 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 49(3),37,1986

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