2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione

2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione 基本信息
CAS号 54824-18-9 分子式 C18H19N3O4
分子量 341.36100 精确质量  341.13800
PSA  88.13000 LogP  2.72590

基本信息 展开↓

CAS号:
54824-18-9
3D弹球模型:
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分子式:
C18H19N3O4
分子量:
341.36100
英文名称:
2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione
英文别名:
2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione;
2-(2-diethylaminoethyl)-5-nitrobenzo[de]isoquinoline-1,3-dione;
5-nitro-2-(2-diethylaminoethyl)-1H-benzisoquinoline-1,3(2H)-dione;
{1H-Benz[de]isoquinoline-1,3(2H)-dione,} {2-[2-(diethylamino)ethyl]-5-nitro-};
1H-Benz[de]isoquinoline-1,2-[2-(diethylamino)ethyl]-5-nitro;
2-(2-(Diethylamino)ethyl)-5-(hydroxy(oxido)amino)-1H-benzo[de]isoquinoline-1,3(2H)-dione
精确分子量/精确质量:
341.13800
极性分子表面积/PSA:
88.13000
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: DBNAILSOGASZLR-UHFFFAOYSA-N

物化性质展开↓

密度:
1.316g/cm3
沸点:
514.3ºC at 760 mmHg
闪点:
264.9ºC
折射率:
1.641

安全信息展开↓

海关代码:
2933990090

合成路线查看所有的合成路线

  • 3027-38-1

    3-硝基-1,8-萘二甲酸酐

  • +

  • 100-36-7

    N,N-二乙基乙二胺

  • ~67%

  • 54824-18-9

    2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione

  • 162265-50-1

    2-(2-diethylaminoethyl)-1H-benz(de)isoquinoline-1,3(2H)-dione

  • ~62%

  • 54824-18-9

    2-[2-(diethylamino)ethyl]-5-nitrobenzo[de]isoquinoline-1,3-dione

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QK5630000
CHEMICAL NAME :
Naphthalimide, 2-(2-(diethylamino)ethyl)-5-nitro-
CAS REGISTRY NUMBER :
54824-18-9
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C18-H19-N3-O4
MOLECULAR WEIGHT :
341.40
WISWESSER LINE NOTATION :
T666 1A M CVNVJ D2N2&2 HNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
32500 ug/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
CCPHDZ Cancer Chemotherapy and Pharmacology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1978- Volume(issue)/page/year: 4,61,1980
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
13000 ug/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
CCPHDZ Cancer Chemotherapy and Pharmacology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1978- Volume(issue)/page/year: 4,61,1980

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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