1707-15-9

1707-15-9结构式
1707-15-9结构式

化源商城直购

中文名 甲烟肼
英文名 N'-[[2-(pyridine-4-carbonyl)hydrazinyl]methyl]pyridine-4-carbohydrazide
英文别名 Methazide
Metazide
Isonicotinic acid 2,2'-methylenedihydrazide
Methazid
Bis(isonicotinylhydrazo)methane
Methazidum
Metazida [Spanish]
bis-(N'-isonicotinoyl-hydrazino)-methane
Metazidum [Latin]
Metazid
Methylenbis(isonicotinylhydrazid)
Bis-(N'-isonicotinoyl-hydrazino)-methan
N,N-Methylenebisisoniazid
密度 1.309g/cm3
沸点 451.8ºC at 760mmHg
分子式 C13H14N6O2
分子量 286.28900
闪点 227.1ºC
精确质量 286.11800
PSA 108.04000
LogP 1.16670
蒸汽压 2.36E-08mmHg at 25°C
折射率 1.616
计算化学

1.疏水参数计算参考值(XlogP):-0.3

2.氢键供体数量:4

3.氢键受体数量:6

4.可旋转化学键数量:6

5.互变异构体数量:10

6.拓扑分子极性表面积:108

7.重原子数量:21

8.表面电荷:0

9.复杂度:308

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NS1987000
CHEMICAL NAME :
Isonicotinic acid, 2,2'-methylenedihydrazide
CAS REGISTRY NUMBER :
1707-15-9
BEILSTEIN REFERENCE NO. :
0294524
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H14-N6-O2
MOLECULAR WEIGHT :
286.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3900 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PSEBAA Proceedings of the Society for Experimental Biology and Medicine. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1903/04- Volume(issue)/page/year: 84,220,1953

海关编码 2933399090

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1707-15-9结构式

1707-15-9

文献:Bose Journal of Scientific and Industrial Research, 1957 , vol. 16 B, p. 323 Full Text Show Details Sytschewa Chimija Med.Chem.Abstr., 1960 , # 14 p. 5,7 Chimija Med.Chem.Abstr., 1963 , vol. 58, p. 498
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海关编码 2933399090
中文概述 2933399090. 其他结构含非稠合吡啶环的化合物. 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
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%