2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione

2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione 基本信息
CAS号 800-24-8 分子式 C16H22N2O6
分子量 338.35600 精确质量 　338.14800
PSA 　77.08000 LogP 　-0.60560
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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：
800-24-8
3D弹球模型：
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分子式：
C16H22N2O6
分子量：
338.35600
英文名称：
2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione
英文别名：
2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione;
A-139;
E 39 Soluble;
AZIRIDYL BENZOQUINONE;
BAY A 139;
Bayer A 139;
Bayer E39 soluble;
Benzoquinone aziridine
精确分子量/精确质量：
338.14800
极性分子表面积/PSA：
77.08000
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: ASWYYIAZATTZLB-UHFFFAOYSA-N

物化性质展开↓

密度：
1.33g/cm3
沸点：
500ºC at 760 mmHg
闪点：
256.2ºC
折射率：
1.576
蒸汽压：
3.94E-10mmHg at 25°C
存储条件/存储方法：
通风低温干燥,与库房食品原料分开存放

合成路线查看所有的合成路线

  • 118-75-2

    四氯对醌

  • →

  • 800-24-8

    2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione

  • 7251-14-1

    2,5-bis(aziridin-1-yl)-3,6-dichlorocyclohexa-2,5-diene-1,4-dione

  • +

  • 3139-99-9

    甲氧基乙醇钠

  • →

  • 800-24-8

    2,5-bis(aziridin-1-yl)-3,6-bis(2-methoxyethoxy)cyclohexa-2,5-diene-1,4-dione

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DK3325000
CHEMICAL NAME :
p-Benzoquinone, 2,5-bis(1-aziridinyl)-3,6-bis(2-methoxyethoxy)-
CAS REGISTRY NUMBER :
800-24-8
BEILSTEIN REFERENCE NO. :
0320574
LAST UPDATED :
199612
DATA ITEMS CITED :
10
MOLECULAR FORMULA :
C16-H22-N2-O6
MOLECULAR WEIGHT :
338.40
WISWESSER LINE NOTATION :
L6V DVJ BO2O1 EO2O1 C- AT3NTJ& F- AT3NTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
250 ug/kg
TOXIC EFFECTS :
Gastrointestinal - other changes Blood - leukopenia Blood - thrombocytopenia
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Primate - monkey
DOSE/DURATION :
500 ug/kg
TOXIC EFFECTS :
Gastrointestinal - other changes Blood - leukopenia Blood - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
4 mg/kg/4W
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors
TYPE OF TEST :
Dominant lethal test

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Human Leukocyte
DOSE/DURATION :
500 nmol/L
REFERENCE :
EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 29,1154,1973 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 9,51,1975 IARC Cancer Review:Human No Adequate Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 9,51,1975 IARC Cancer Review:Group 3 IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987

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  • 7251-14-1

    2,5-bis(aziridin-1-yl)-3,6-dichlorocyclohexa-2,5-diene-1,4-dione

  • 3139-99-9

    甲氧基乙醇钠

  • 118-75-2

    四氯对醌

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