三苯基乙酸铅

三苯基乙酸铅 基本信息
CAS号 1162-06-7 分子式 C20H18O2Pb
分子量 497.58008 精确质量  498.10732
PSA  26.30000 LogP  4.09340

基本信息 展开↓

CAS号:
1162-06-7
3D弹球模型:
立即前往扯扯看
分子式:
C20H18O2Pb
分子量:
497.58008
中文名称:
三苯基乙酸铅
英文名称:
Acetic acid, triphenylplumbyl ester
中文别名:
三苯基乙酸铅;
三苯基醋酸铅;
(-)-Phenylalanine;
(S)-(-)-Phenylalanine;
(S)-A-Aminobenzenepropanoic Acid;
(S)-a-Amino-b-phenylpropionic Acid;
(S)-a-Aminohydrocinnamic Acid;
(S)-alpha-Aminobenzenepropanoic acid;
Benzenepropanoic acid, .alpha.-amino-, (S)-;
F;
fenilalanina;
N-[(benzyloxy)carbonyl]-L-phenylalanine;
N-[(benzyloxy)carbonyl]phenylalanine;
(2S)-2-{[(benzyloxy)carbonyl]amino}-3-phenylpropanoate;
N-CBZ-L-PHENYLALANINE;
CBZ-L-Phe-OH;
Cbz-L-phenylalanine;
Z-Phe;
CARBOBENZOXYPHENYLALANINE;
Z-Val-OH;
CBZ-L-Valacyclovir;
N-Benzyloxycarbonyl-L-valine;
(+)-Limonene oxide, mixture of cis and trans;
N,N-dimethylpyridin-2-amine;
4-(dimethylamino)pyridinium;
4dimethylaminopyridine;
4-dimethylamiopryidine;
Dimethyl-pyridin-4-yl-amine;
Dimethyl-pyridin-4-yl-amine(DMAP);
N-(4-Pyridyl)dimethylamine;
4-Dimethylaminopyridine
英文别名:
Acetic acid, triphenylplumbyl ester;
Lead, acetoxytriphenyl- (7CI);
Plumbane, (acetyloxy)triphenyl- (9CI);
Plumbane, acetoxytriphenyl- (8CI);
Acetatotriphenyllead;
Acetoxytriphenyllead;
Acetoxytriphenylplumbane;
NSC 88644;
Triphenylacetoxylead;
Triphenyllead acetate
精确分子量/精确质量:
498.10732
极性分子表面积/PSA:
26.30000
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。
贝尔斯坦号/MDL:
1162-06-7
EINECS:
214-601-2
InChI:
InChI=1/3C6H5.C2H4O2.Pb/c3*1-2-4-6-5-3-1;1-2(3)4;/h3*1-5H;1H3,(H,3,4);/rC18H15Pb.C2H4O2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2(3)4/h1-15H;1H3,(H,3,4)

安全信息展开↓

海关代码:
2916399090
危险类别码:
61-20/22-33-50/53-62

合成路线查看所有的合成路线

  • 563-63-3

    乙酸银

  • +

  • 1153-06-6

    氯化三苯基铅

  • 1162-06-7

    三苯基乙酸铅

  • 27810-47-5

    27810-47-5

  • 1162-06-7

    三苯基乙酸铅

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TP3922200
CHEMICAL NAME :
Plumbane, acetoxytriphenyl-
CAS REGISTRY NUMBER :
1162-06-7
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C20-H18-O2-Pb
MOLECULAR WEIGHT :
497.57
WISWESSER LINE NOTATION :
1VO-PB-R&R&R

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 :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BIJOAK Biochemical Journal. (Biochemical Soc. Book Depot, POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK) V.1- 1906- Volume(issue)/page/year: 127,24P,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2800 ug/kg
TOXIC EFFECTS :
Liver - other changes
REFERENCE :
JJATDK JAT, Journal of Applied Toxicology. (John Wiley & Sons Ltd., Baffins Lane, Chichester, W. Sussex PO19 1UD, UK) V.1- 1981- Volume(issue)/page/year: 1,247,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5 mg/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - acute pulmonary edema
REFERENCE :
JJATDK JAT, Journal of Applied Toxicology. (John Wiley & Sons Ltd., Baffins Lane, Chichester, W. Sussex PO19 1UD, UK) V.1- 1981- Volume(issue)/page/year: 1,247,1981

海关数据查看详细

中国海关编码:2916399090

概述:
2916399090 其他芳香一元羧酸. 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:30.0%
申报要素:
品名, 成分含量, 用途, 丙烯酸、丙烯酸盐或酯应报明包装
摘要/Summary:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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:0

3.氢键受体数量:2

4.可旋转化学键数量:5

5.互变异构体数量:无

6.拓扑分子极性表面积26.3

7.重原子数量:23

8.表面电荷:0

9.复杂度:332

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

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