6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole 基本信息
CAS号 1210-56-6 分子式 C13H16N2O
分子量 216.27900 精确质量  216.12600
PSA  37.05000 LogP  2.71200

基本信息 展开↓

CAS号:
1210-56-6
3D弹球模型:
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分子式:
C13H16N2O
分子量:
216.27900
英文名称:
6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
英文别名:
6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;
adrenoglomerulotropin;
6-Methoxytetrahydroharman;
1-Methyl-6-methoxy-1,2,3,4-tetrahydro-2-carboline
精确分子量/精确质量:
216.12600
极性分子表面积/PSA:
37.05000
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: RDUORFDQRFHYBF-UHFFFAOYSA-N

物化性质展开↓

密度:
1.145g/cm3
沸点:
399.2ºC at 760mmHg
闪点:
195.2ºC
折射率:
1.61
蒸汽压:
1.4E-06mmHg at 25°C

安全信息展开↓

海关代码:
2933990090

合成路线查看所有的合成路线

  • 66-83-1

    5-甲氧基色胺盐酸盐

  • +

  • 75-07-0

    乙醛

  • ~80%

  • 1210-56-6

    6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

  • 66-83-1

    5-甲氧基色胺盐酸盐

  • 1210-56-6

    6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

  • 29573-11-3

    29573-11-3

  • 1210-56-6

    6-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV0740000
CHEMICAL NAME :
9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-6-methoxy-1-methyl-
CAS REGISTRY NUMBER :
1210-56-6
BEILSTEIN REFERENCE NO. :
0747865
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C13-H16-N2-O
MOLECULAR WEIGHT :
216.31
WISWESSER LINE NOTATION :
T B656 EM HMT&&J F1 LO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
350 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - excitement Behavioral - changes in motor activity (specific assay)
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: 27,165,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#12476 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M2659 No. of Facilities: 492 (estimated) No. of Industries: 16 No. of Occupations: 29 No. of Employees: 5952 (estimated)

海关数据查看详细

中国海关编码:2933990090

概述:
2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
摘要/Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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