ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE

ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE 基本信息
CAS号 1118-76-9 分子式 C7H13N3O2S
分子量 203.26200 精确质量  203.07300
PSA  108.80000 LogP  1.23990

基本信息 展开↓

CAS号:
1118-76-9
3D弹球模型:
立即前往扯扯看
分子式:
C7H13N3O2S
分子量:
203.26200
中文名称:
ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE
英文名称:
ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE
中文别名:
ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE
英文别名:
ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE;
3-Mercaptoquinoline;
3-quinolinylmercaptan;
Acetessigsaeure-aethylester-thiosemicarbazon;
3-thiosemicarbazono-butyric acid ethyl ester;
3-thioquinoline;
3-Quinolinethiol;
syn(CH3)-Acetessigester-thiosemicarbazon;
Acetessigesterthiosemicarbazon;
3-Thiosemicarbazono-buttersaeure-aethylester;
Chinolin-3-thiol;
Ethyl-3-oxobutyrat-3-thiosemicarbazon
精确分子量/精确质量:
203.07300
极性分子表面积/PSA:
108.80000
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: WQKFYGJPNATGJS-UHFFFAOYSA-N

物化性质展开↓

密度:
1.25g/cm3
沸点:
312.7ºC at 760 mmHg
闪点:
142.9ºC
折射率:
1.554
蒸汽压:
0.00052mmHg at 25°C

安全信息展开↓

海关代码:
2930909090

合成路线查看所有的合成路线

  • 141-97-9

    乙酰乙酸乙酯

  • 1118-76-9

    ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE

  • 4346-94-5

    氨基硫脲单盐酸盐

  • 1118-76-9

    ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE

  • 141-97-9

    乙酰乙酸乙酯

  • +

  • 79-19-6

    灭鼠特

  • 1118-76-9

    ACETOACETIC ACID, ETHYL ESTER, THIOSEMICARBAZONE

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AK5450000
CHEMICAL NAME :
Acetoacetic acid, ethyl ester, 3-(thiosemicarbazone)
CAS REGISTRY NUMBER :
1118-76-9
BEILSTEIN REFERENCE NO. :
1788841
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H13-N3-O2-S
MOLECULAR WEIGHT :
203.29

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 :
75 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - excitement
REFERENCE :
AITEAT Archivum Immunologiae et Therapiae Experimentalis. (Ars Polona, POB 1001, 00-068 Warsaw 1, Poland) V.10- 1962- Volume(issue)/page/year: 16,676,1968

海关数据查看详细

中国海关编码:2930909090

概述:
2930909090. 其他有机硫化合物. 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:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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