2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol

2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol 基本信息
CAS号 5135-83-1 分子式 C14H20N2O
分子量 232.32100 精确质量 　232.15800
PSA 　28.40000 LogP 　2.25620
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目录
基本信息 物化性质 合成路线 毒性 上下游

基本信息 展开↓

CAS号：
5135-83-1
3D弹球模型：
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分子式：
C14H20N2O
分子量：
232.32100
英文名称：
2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol
英文别名：
2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol;
1-(1-Aethyl-indol-3-yl)-2-dimethylamino-aethanol;
1-(1-ethyl-indol-3-yl)-2-dimethylamino-ethanol
精确分子量/精确质量：
232.15800
极性分子表面积/PSA：
28.40000
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: STKHFYZBZLFYSR-UHFFFAOYSA-N

物化性质展开↓

密度：
1.06g/cm3
沸点：
395.7ºC at 760 mmHg
闪点：
193.1ºC
折射率：
1.559

合成路线查看所有的合成路线

  • 29095-44-1

    1H-Indole-3-acetamide,N,N-dimethyl-伪-oxo-

  • →

  • 5135-83-1

    2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol

  • 22980-09-2

    吲哚-3-乙醛酰氯

  • →

  • 5135-83-1

    2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol

  • 120-72-9

    吲哚

  • →

  • 5135-83-1

    2-(dimethylamino)-1-(1-ethylindol-3-yl)ethanol

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL9485600
CHEMICAL NAME :
Indole-3-methanol, alpha-((dimethylamino)methyl)-1-ethyl-
CAS REGISTRY NUMBER :
5135-83-1
BEILSTEIN REFERENCE NO. :
0192669
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C14-H20-N2-O
MOLECULAR WEIGHT :
232.36
WISWESSER LINE NOTATION :
T56 BNJ B2 DYQ1N1&1

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 :
80 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 6,75,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
233 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 6,75,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
133 mg/kg
TOXIC EFFECTS :
Vascular - BP lowering not characterized in autonomic section Kidney, Ureter, Bladder - urine volume increased
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 6,75,1963
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
1 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 6,75,1963

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  • 120-72-9

    吲哚

  • 22980-09-2

    吲哚-3-乙醛酰氯

  • 29095-44-1

    1H-Indole-3-acetamide,N,N-dimethyl-伪-oxo-

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