2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate

2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate 基本信息
CAS号 41349-35-3 分子式 C22H21NO8S
分子量 459.46900 精确质量  459.09900
PSA  115.61000 LogP  3.89040

基本信息 展开↓

CAS号:
41349-35-3
3D弹球模型:
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分子式:
C22H21NO8S
分子量:
459.46900
中文名称:
2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate
英文名称:
2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate
中文别名:
2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate
英文别名:
2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate;
Nitidine methosulfate;
nitidinium,methyl sulfate;
2,3-Dimethoxy-12-methyl-(1,3)-benzodioxolo(5,6-c)phenanthridinium methylsulfate;
2,3-dimethoxy-12-methyl-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium,methyl sulfate;
Nitidine methyl sulfate;
(1,3)-Benzodioxolo(5,6-c)phenanthridinium,2,3-dimethoxy-12-methyl-,methylsulfate;
2,3-Dimethoxy-12-methyl-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium,Methylsulfat
精确分子量/精确质量:
459.09900
极性分子表面积/PSA:
115.61000
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: RQQPNGIYTFBRBS-UHFFFAOYSA-M

合成路线查看所有的合成路线

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    2,3-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]phenanthridine

  • 41349-35-3

    2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate

  • 13063-06-4

    2,3-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridine

  • 41349-35-3

    2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate

  • 548-31-2

    2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-13-one

  • 41349-35-3

    2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,methyl sulfate

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF4935600
CHEMICAL NAME :
(1,3)-Benzodioxolo(5,6-c)phenanthridinium, 2,3-dimethoxy-12-methyl-, methylsulfate
CAS REGISTRY NUMBER :
41349-35-3
LAST UPDATED :
199410
WISWESSER LINE NOTATION :
T G5 E6 B666 HO JO OK IHJ O1 SO1 TO1 &WSO&O1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
40 ug/plate
REFERENCE :
JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 66,1781,1977

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