cas号： 110311-27-8 ，名称：磺氯苯脲的性质/作用/用途-化学加百科

磺氯苯脲

磺氯苯脲基本信息
CAS号	110311-27-8	分子式	C16H15ClN2O3S
分子量	350.82000	精确质量	350.04900
PSA	83.65000	LogP	4.88380

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基本信息物化性质安全信息合成路线毒性海关数据结构与计算数据上下游

基本信息展开↓

CAS号：: 110311-27-8
3D弹球模型：: 立即前往扯扯看
分子式：: C16H15ClN2O3S
分子量：: 350.82000
中文名称：: 磺氯苯脲
英文名称：: 1-(4-chlorophenyl)-3-(2,3-dihydro-1H-inden-5-ylsulfonyl)urea
中文别名：: 磺氯苯脲
英文别名：: 1-(4-chlorophenyl)-3-(2,3-dihydro-1H-inden-5-ylsulfonyl)urea;
N-(5-Indansulfonyl)-N'-(4-chlorophenyl)urea;
SULOFENUR;
Sulofenurum [INN-Latin];
N-[[(4-chlorophenyl)amino]carbonyl]-indan-5-sulfonamide;
N-(Indanyl-5-sulfonyl)-N'-(4-chlorophenyl)urea;
N-([(4-chlorophenyl)amino]carbonyl)-2,3-dihydro-1H-indene-5-sulfonamide;
1-(p-Chlorophenyl)-3-(5-indanylsulfonyl)urea
精确分子量/精确质量：: 350.04900
极性分子表面积/PSA：: 83.65000
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: JQJSFAJISYZPER-UHFFFAOYSA-N

物化性质展开↓

密度：: 1.449g/cm3
折射率：: 1.656

安全信息展开↓

海关代码：: 2935009090

合成路线查看所有的合成路线

52405-96-6

2,3-dihydro5-indenylsulfonylisocyanate
+
106-47-8

对氯苯胺
→

~86%
110311-27-8

磺氯苯脲

35203-93-1

2,3-dihydro-1H-indene-5-sulfonamide
+
104-12-1

对氯苯异氰酸酯
→

~76%
110311-27-8

磺氯苯脲

52205-86-4

N-(5-indansulfonyl)carbamate
+
106-47-8

对氯苯胺
→
110311-27-8

磺氯苯脲

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NK8730000

CHEMICAL NAME :: 1H-Indene-5-sulfonamide, 2,3-dihydro-N-(((4-chlorophenyl)amino)carbonyl)-

CAS REGISTRY NUMBER :: 110311-27-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C16-H15-Cl-N2-O3-S

MOLECULAR WEIGHT :: 350.84

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 16,517,1991

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 16,517,1991 ** REPRODUCTIVE DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

DOSE :: 2940 mg/kg

SEX/DURATION :: male 14 week(s) pre-mating

TOXIC EFFECTS :: Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count) Reproductive - Paternal Effects - testes, epididymis, sperm duct

REFERENCE :: REPTED Reproductive Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1987- Volume(issue)/page/year: 6,47,1992

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

DOSE :: 2940 mg/kg

SEX/DURATION :: male 14 week(s) pre-mating

TOXIC EFFECTS :: Reproductive - Fertility - male fertility index (e.g. # males impregnating females per # males exposed to fertile nonpregnant females) Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)

REFERENCE :: REPTED Reproductive Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1987- Volume(issue)/page/year: 6,47,1992

海关数据查看详细

中国海关编码：2935009090

概述：: 2935009090 其他磺（酰）胺. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:6.5% 普通关税:35.0%
申报要素：: 品名, 成分含量, 用途
摘要/Summary：: 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%

分子结构与计算化学数据展开↓

计算化学数据

1.疏水参数计算参考值（XlogP）:无

2.氢键供体数量:2

3.氢键受体数量:3

4.可旋转化学键数量:3

5.互变异构体数量:3

6.拓扑分子极性表面积:83.6

7.重原子数量:23

8.表面电荷:0

9.复杂度:526

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

上下游相关产品

上游产品

35203-93-1

2,3-dihydro-1H-indene-5-sulfonamide
104-12-1

对氯苯异氰酸酯
52405-96-6

2,3-dihydro5-indenylsulfonylisocyanate
106-47-8

对氯苯胺
52205-86-4

N-(5-indansulfonyl)carbamate