吖丙啶基 甲酸乙酯

吖丙啶基 甲酸乙酯 基本信息
CAS号 671-51-2 分子式 C5H9NO2
分子量 115.13000 精确质量  115.06300
PSA  29.31000 LogP  0.39640

基本信息 展开↓

CAS号:
671-51-2
3D弹球模型:
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分子式:
C5H9NO2
分子量:
115.13000
中文名称:
吖丙啶基 甲酸乙酯
英文名称:
ethyl aziridine-1-carboxylate
中文别名:
吖丙啶基 甲酸乙酯;
吖丙啶基甲酸乙酯;
Pentafluoropyridine;
2,3,5-Trimethylhydroquinone;
2,3,5-trimethylbenzene-1,4-diol;
Trimethylhydroquinone;
1H-Indole-3-methanol;
I3C;
AKOS NCG1-0099;
3-Indole methanol;
Indo-3-Carbinol;
Indole-3-carbinol;
1-phenylmethanamine-trifluoroborane (1:1);
Borontrifluoride-Benzylamin-complex;
Benzylamine-boron trifluoride complex;
Boron Trifluoride Benzylamine;
p-Oxal-methyline;
RESICURE(TM) 46;
AKOS BBS-00004447;
2-Methylglyoxaline;
Epicure MI 2;
Epikure MI 2;
IMicure AMI 2;
NSC 21394;
2-Methylimidazole;
Benzenamine, 2-methyl-, hydrochloride (1:1);
o-Toluidine, hydrochloride;
RCRA waste no. U222;
2-methylaniline hydrochloride (1:1);
o-Tolidine hydroch;
N-Acetyl Cysteine;
N-acetylcysteine;
(2R)-2-(acetylamino)-3-sulfanylpropanoate;
N-Acetyl-cysteine;
N-Acetyl-L-cysteine
英文别名:
ethyl aziridine-1-carboxylate;
Ethyl aziridinylformate;
Aziridin-1-carbonsaeure-aethylester;
aziridine-1-carboxylic acid ethyl ester;
Ethyl aziridinocarboxylate;
Ethyl 1-aziridinylcarboxylate;
N-Ethoxycarbonylethyleneimine;
1-Ethoxycarbonylaziridine;
Ethyl 1-aziridinecarboxylate;
1-Ethoxycarbonyl-aziridin;
Ethyl N,N-ethylenecarbamate;
Ethyl aziridinecarboxylate;
Aziridinecarboxylic acid,ethyl ester;
Ethoxycarbonyl-1-ethylenimine;
N-Carbethoxyethylenimine
精确分子量/精确质量:
115.06300
极性分子表面积/PSA:
29.31000
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:
InChI=1/C5H9NO2/c1-2-8-5(7)6-3-4-6/h2-4H2,1H3

物化性质展开↓

密度:
1.169g/cm3
沸点:
147.1ºC at 760 mmHg
闪点:
42.8ºC
折射率:
1.488
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

安全信息展开↓

海关代码:
2933990090

合成路线查看所有的合成路线

  • 17619-22-6

    ch2=c=nh

  • +

  • 541-41-3

    氯甲酸乙酯

  • ~28%

  • 671-51-2

    吖丙啶基 甲酸乙酯

  • 151-56-4

    乙烯亚胺

  • +

  • 541-41-3

    氯甲酸乙酯

  • 671-51-2

    吖丙啶基 甲酸乙酯

  • 5602-93-7

    ethyl 2-hydroxy-ethylcarbamate

  • 671-51-2

    吖丙啶基 甲酸乙酯

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CM6800000
CHEMICAL NAME :
1-Aziridinecarboxylic acid, ethyl ester
CAS REGISTRY NUMBER :
671-51-2
BEILSTEIN REFERENCE NO. :
0110143
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C5-H9-N-O2
MOLECULAR WEIGHT :
115.15
WISWESSER LINE NOTATION :
T3NTJ AVO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
8600 ug/kg
TOXIC EFFECTS :
Kidney, Ureter, Bladder - urine volume increased
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TEST SYSTEM :
Rodent - rat
DOSE/DURATION :
40 mg/kg
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 6,357,1951

海关数据查看详细

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%

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  • 17619-22-6

    ch2=c=nh

  • 541-41-3

    氯甲酸乙酯

  • 5602-93-7

    ethyl 2-hydroxy-ethylcarbamate

  • 151-56-4

    乙烯亚胺

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