2-(3,4-dimethoxyphenyl)ethylurea

2-(3,4-dimethoxyphenyl)ethylurea 基本信息
CAS号 25017-47-4 分子式 C11H16N2O3
分子量 224.25600 精确质量  224.11600
PSA  73.58000 LogP  2.00580

基本信息 展开↓

CAS号:
25017-47-4
3D弹球模型:
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分子式:
C11H16N2O3
分子量:
224.25600
英文名称:
2-(3,4-dimethoxyphenyl)ethylurea
英文别名:
2-(3,4-dimethoxyphenyl)ethylurea;
1-(3,4-dimethoxyphenethyl)urea;
N-(3,4-dimethoxyphenethyl)urea;
(3,4-Dimethoxy-phenaethyl)-harnstoff;
1-2-(3,4-dimethoxyphenyl)ethyl urea;
N-<2-(3,4-dimethoxyphenylethyl)>urea;
Urea,(3,4-dimethoxyphenethyl);
(3,4-dimethoxy-phenethyl)-urea
精确分子量/精确质量:
224.11600
极性分子表面积/PSA:
73.58000
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: MDAOEGJTBPQGCB-UHFFFAOYSA-N

物化性质展开↓

密度:
1.141g/cm3
沸点:
367.6ºC at 760 mmHg
闪点:
176.1ºC
折射率:
1.533
蒸汽压:
1.35E-05mmHg at 25°C

合成路线查看所有的合成路线

  • 120-20-7

    3,4-二甲氧基苯乙胺

  • +

  • 598-55-0

    氨基甲酸甲酯

  • ~89%

  • 25017-47-4

    2-(3,4-dimethoxyphenyl)ethylurea

  • 120-20-7

    3,4-二甲氧基苯乙胺

  • +

  • 57-13-6

    尿素

  • ~44%

  • 25017-47-4

    2-(3,4-dimethoxyphenyl)ethylurea

  • 21997-97-7

    21997-97-7

  • 25017-47-4

    2-(3,4-dimethoxyphenyl)ethylurea

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS9863000
CHEMICAL NAME :
Urea, (3,4-dimethoxyphenethyl)-
CAS REGISTRY NUMBER :
25017-47-4
BEILSTEIN REFERENCE NO. :
2736376
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H16-N2-O3
MOLECULAR WEIGHT :
224.29
WISWESSER LINE NOTATION :
ZVM2R CO1 DO1

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 :
>3 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 21,366,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
336 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
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: 52,211,1934

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