双丙氧亚胺醌
- 中文名称:
- 双丙氧亚胺醌
- 中文别名:
- 双丙氧亚胺醌;
英丙醌 氮丙啶丙氧醌
- 英文名称:
- 2,5-Cyclohexadiene-1,4-dione,2,5-bis(1-aziridinyl)-3,6-dipropoxy-
- 英文别名:
- 2,5-bis(aziridin-1-yl)-3,6-dipropoxycyclohexa-2,5-diene-1,4-dione;
Bayer E 39;
2,5-bis-aziridin-1-yl-3,6-dipropoxy-[1,4]benzoquinone;
2,5-Bis-aziridin-1-yl-3,6-dipropoxy-[1,4]benzochinon;
Cytostaticum;
Improcuona [INN-Spanish];
Zytostatika;
Inprochonum;
Inproquonum [INN-Latin];
Cytostatika;
2.5-Bis--3.6-di-propyloxy-benzochinon-(1.4);
Inproquone;
E 39;
RP 6870
- CAS No.:
- 436-40-8
- 分 子 式:
-
C16H22N2O4
- 分 子 量:
- 306.40
- 精确分子量:
- 306.15800
- PSA:
- 58.62000
- InChI:
- The Key: NOVZFMNCTCKLPF-UHFFFAOYSA-N3
- 安全术语:
- Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
- 分子结构式:
-
- SDS:
- 查看
双丙氧亚胺醌 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DK3327000
- CHEMICAL NAME :
- p-Benzoquinone, 2,5-bis(1-aziridinyl)-3,6-dipropoxy-
- CAS REGISTRY NUMBER :
- 436-40-8
- BEILSTEIN REFERENCE NO. :
- 0286633
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 8
- MOLECULAR FORMULA :
- C16-H22-N2-O4
- MOLECULAR WEIGHT :
- 306.40
- WISWESSER LINE NOTATION :
- T3NTJ A- BL6V DVJ CO3 FO3 E- AT3NTJ
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4300 ug/kg
- TOXIC EFFECTS :
- Gastrointestinal - hypermotility, diarrhea
Blood - hemorrhage
Nutritional and Gross Metabolic - other changes
- TYPE OF TEST :
- Sex chromosome loss and nondisjunction
- TYPE OF TEST :
- Cytogenetic analysis
- TYPE OF TEST :
- Sister chromatid exchange
MUTATION DATA
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Rodent - hamster Cells - not otherwise specified
- DOSE/DURATION :
- 290 nmol/L
- REFERENCE :
- SOGEBZ Soviet Genetics. English translation of GNKAA5. (Plenum Pub. Corp.,
233 Spring St., New York, NY 10013) V.2- 1966- Volume(issue)/page/year:
18,210,1982
双丙氧亚胺醌 海关数据
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%
双丙氧亚胺醌 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):无
2.氢键供体数量:0
3.氢键受体数量:6
4.可旋转化学键数量:8
5.互变异构体数量:无
6.拓扑分子极性表面积:58.6
7.重原子数量:22
8.表面电荷:0
9.复杂度:507
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1