3a,6a-二甲基甘脲
- 中文名称:
- 3a,6a-二甲基甘脲
- 中文别名:
- 3a,6a-二甲基甘脲;
3-Amino-DL-Phenylalanine;
3-(1-Naphthyl)-DL-alanine DL-2-Amino-3-(1-naphthyl)propanoic acid;
3-naphthalen-1-yl-L-alanine;
3-naphthalen-1-ylalanine;
dl-3-(1-naphthyl)alanine;
(1S)-2-methyl-4-oxo-3-(prop-2-en-1-yl)cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate;
D-Trans-Allethrin;
3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine-p,p'-disulfonic acid disodium salt xH2O;
1,1,1-This(4-hydroxyphenyl)ethane;
1,1,1-tris(4-hydro
- 英文名称:
- Imidazo[4,5-d]imidazole-2,5(1H,3H)-dione,tetrahydro-3a,6a-dimethyl-
- 英文别名:
- 3a,6a-dimethyl-1,3,4,6-tetrahydroimidazo[4,5-d]imidazole-2,5-dione;
tetrahydro-3a,6a-dimethylimidazo<4,5-d>imidazole-2,5-(1H,3H)-dione;
Diacetyldiurein;
7,8-Dimethylglycoluril;
3a,6a-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione;
1,5-Dimethylglykoluril;
3a,7a-dimethyltetrahydroimidazo<4,5-d>imidazole-2,5-dione;
dimethylglycoluril;
3a,6a-dimethylglycoluril;
3a,6a-dimethylperhydroimidazo[4,5-d]imidazole-2,5-dione;
1,5-dimethyl-2,4,6,8-tetraazabicyclo<3,3,0>octan-3,7-dione;
Diacetyl diurea;
GLYCOLURIL,3a,6a-DIMETHYL
- CAS No.:
- 28115-25-5
- 分 子 式:
-
C6H10N4O2
- 分 子 量:
- 170.16900
- 精确分子量:
- 170.08000
- PSA:
- 82.26000
- InChI:
- InChI=1/C6H10N4O2/c1-5-6(2,9-3(11)7-5)10-4(12)8-5/h1-2H3,(H2,7,9,11)(H2,8,10,12)3
- 分子结构式:
-

- SDS:
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3a,6a-二甲基甘脲 物化性质
- 密度:
- 1.313g/cm3
- 沸点:
- 602.6ºC at 760 mmHg
- 闪点:
- 295ºC
- 折射率:
- 1.519
- 蒸汽压:
- 1.78E-14mmHg at 25°C
3a,6a-二甲基甘脲 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- MD1050000
- CHEMICAL NAME :
- Glycoluril, 3a,6a-dimethyl-
- CAS REGISTRY NUMBER :
- 28115-25-5
- BEILSTEIN REFERENCE NO. :
- 0141752
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C6-H10-N4-O2
- MOLECULAR WEIGHT :
- 170.20
- WISWESSER LINE NOTATION :
- T55 BMVM FMVMTJ A1 E1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 50 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams &
Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10-
Volume(issue)/page/year: 93,287,1948
3a,6a-二甲基甘脲 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):-1.2
2.氢键供体数量:4
3.氢键受体数量:2
4.可旋转化学键数量:0
5.互变异构体数量:4
6.拓扑分子极性表面积:82.3
7.重原子数量:12
8.表面电荷:0
9.复杂度:231
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