N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide

N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide 基本信息
CAS号 5702-68-1 分子式 C18H17N3O2
分子量 307.34600 精确质量  307.13200
PSA  59.52000 LogP  3.12070

基本信息 展开↓

CAS号:
5702-68-1
3D弹球模型:
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分子式:
C18H17N3O2
分子量:
307.34600
英文名称:
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide
英文别名:
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide;
4-benzoylamino-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one;
4-{(N-benzoyl)amino}antipyrine;
N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-benzamid;
Benzamide,N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl);
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-benzamide;
4-Benzamidoantipyrine;
BENZAMIDE,N-ANTIPYRINYL;
N-Antipyrinylbenzamide;
N-(1,5-DIMETHYL-3-OXO-2-PHENYL-PYRAZOL-4-YL)BENZAMIDE;
4-Benzamino-2,3-dimethyl-1-phenyl-pyrazolon-(5);
4-Benzoylamino-antipyrin;
1-Phenyl-2,3-dimethyl-4-benzoylamino-5-pyrazolone;
benzalaminophenazone
精确分子量/精确质量:
307.13200
极性分子表面积/PSA:
59.52000
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: TWAXSNQMTXARTQ-UHFFFAOYSA-N

物化性质展开↓

密度:
1.29g/cm3
折射率:
1.666

安全信息展开↓

海关代码:
2933199090

合成路线查看所有的合成路线

  • 83-07-8

    4-氨基安替比林

  • +

  • 98-88-4

    苯甲酰氯

  • ~63%

  • 5702-68-1

    N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide

  • 885-11-0

    1,5-dimethyl-4-nitroso-2-phenylpyrazol-3-one

  • +

  • 100-52-7

    苯甲醛

  • 5702-68-1

    N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CV2340500
CHEMICAL NAME :
Benzamide, N-antipyrinyl-
CAS REGISTRY NUMBER :
5702-68-1
BEILSTEIN REFERENCE NO. :
0036367
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H17-N3-O2
MOLECULAR WEIGHT :
307.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 25,55,1962

海关数据查看详细

中国海关编码:2933199090

概述:
2933199090. 其他结构上有非稠合吡唑环化合物. 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:
2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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