5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride

5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride 基本信息
CAS号 78313-59-4 分子式 C18H26Cl2N2O4S2
分子量 469.44600 精确质量 　468.07100
PSA 　148.80000 LogP 　5.29620
我要卖该产品 我要定制合成该产品
充值推广 查看更多供应商
目录
基本信息 物化性质 合成路线 毒性 上下游

基本信息 展开↓

CAS号：
78313-59-4
3D弹球模型：
立即前往扯扯看
分子式：
C18H26Cl2N2O4S2
分子量：
469.44600
英文名称：
5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride
英文别名：
5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride;
3-Pyridinol,5,5'-[dithiobis(methylene)]bis[4-(methoxymethyl)-2-methyl-, dihydrochloride(9CI)
精确分子量/精确质量：
468.07100
极性分子表面积/PSA：
148.80000
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: ZCYOJRLBUWZZEP-UHFFFAOYSA-N

物化性质展开↓

沸点：
652.6ºC at 760 mmHg
闪点：
348.5ºC
存储条件/存储方法：
库房通风低温干燥

合成路线查看所有的合成路线

  • 78313-60-7

    2-Methyl-3-hydroxy-4-methoxymethyl-5-chloromethylpyridine hydrochloride

  • →

  • 78313-59-4

    5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride

  • 3131-27-9

    5-(hydroxymethyl)-4-(methoxymethyl)-2-methylpyridin-3-ol,hydrochloride

  • →

  • 78313-59-4

    5-[[[5-hydroxy-4-(methoxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(methoxymethyl)-2-methylpyridin-3-ol,dihydrochloride

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU7714700
CHEMICAL NAME :
3-Pyridinol, 5,5'-(dithiodimethylene)bis(4-methoxymethyl-2-methyl- , dihydrochloride
CAS REGISTRY NUMBER :
78313-59-4
LAST UPDATED :
198609
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C18-H24-N2-O4-S2.2Cl-H
MOLECULAR WEIGHT :
469.48
WISWESSER LINE NOTATION :
T6NJ B1 CQ D1O1 E1SS1- ET6NJ B1 CQ D1O1 &GH 2

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 :
1450 mg/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions Behavioral - changes in motor activity (specific assay)
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,79,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
434 mg/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions Behavioral - changes in motor activity (specific assay)
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,79,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
111 mg/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions Behavioral - changes in motor activity (specific assay)
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,79,1981

上下游相关产品

上游产品

更多

  • 3131-27-9

    5-(hydroxymethyl)-4-(methoxymethyl)-2-methylpyridin-3-ol,hydrochloride

  • 78313-60-7

    2-Methyl-3-hydroxy-4-methoxymethyl-5-chloromethylpyridine hydrochloride

立即下载安装“化学加”APP
专业、功能强大，随时调用更加方便
下载APP