CAS 523-87-5 MFCD00054265-Dimenhydrinate 茶苯海明 TAO{mole}

Dimenhydrinate 茶苯海明

CAS 523-87-5 MFCD00054265

化学结构图

SMILES: CN(C)CCOC(c1ccccc1)c1ccccc1.Cn1c(=O)c2[nH]c(Cl)nc2n(C)c1=O

化学属性

Mol. Formula	C17H21NO · C7H7ClN4O2
Mol. Weight	469.96
Melting Point	102-107°
Solubility	略溶于水 (0.1-1 G/100 ML AT 22 ºC)
TSCA	Yes

别名和识别编码

Chemical Name	Dimenhydrinate
CAS Number	523-87-5
MDL Number	MFCD00054265
Synonym	N-(2-Diphenylmethoxyethyl)-N,N-dimethylammonium 8-chlorotheophyllinate; 2-(Benzhydryloxy)-N,N-dimethylethylamine 8-chlorotheophyllinate; 8-Chloro-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione compound with 2-(diphenylmethoxy)-N,N-dimethylethanamine (1:1) benzhydryl-beta-dimethylaminoethylether8-chlorotheophylline diamarin 6-dione,8-chloro-3,7-dihydro-1,3-dimethyl-1h-pyrine-compdwith2-(diphenyl 捉迷明 2-(benzhydryloxy)-n,n-dimethylethylamine 8-chlorotheophyllinate 8-chloro-3,7-dihydro-1,3-dimethyl-1h-purine-2,6-dione compound with 2-(diphenylmethoxy)-n,n-dimethylethanamine (1:1) andramine 乘晕宁 antemin O-Benzhydryldimethylaminoethanol 8-chlorotheophyllinate {Chemicalb 2-(benzhydryloxy)-n,n-dimethylethylaminecompd.with8-chlorotheophylline Amosyt N-[2-DIPHENYLMETHOXYETHYL]-N,N-DIMETHYLAMMONIUM 8-CHLORO-THEOPHYLLINATE anautine beta-dimethylaminoethylbenzhydrylether1,3-dimethyl-8-chloroxanthine Dimenhydrinate 茶苯海明 N-(2-Diphenylmethoxyethyl)-N,N-dimethylammonium 8-chlorotheophyllinate Andramine aviomarin 8-chlorotheophylline,compd.with2-(diphenylmethoxy)-n,n-dimethylethylamine 茶苯海明(晕车药) 8-Chlorotheophylline, compd. with Benzhydryl-beta-dimethylaminoethylether 8-chlorotheophylline amosyt 晕海宁 DIMENHYDRINATE 二甲基氢曲拉明 2-(Benzhydryloxy)-N,N-dimethylethylamine compd. with 8-chlorotheophylline chloranautine 6-dione,8-chloro-3,7-dihydro-1,3-dimethyl-1h-purine-compd.with2-(dipheny Chloranautine 1,3- 2-(diphenylmethoxy)-n,n-dimethylethylamine8-chlorotheoph
EC Number	208-350-8
Merck Number	14,3207
Chemical Name Translation	茶苯海明
Wiswesser Line Notation	T56 BM DN FNVNVJ CG F H &622
LabNetwork Molecule ID	LN00222677

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安全信息

GHS Symbol

WGK Germany3

Hazard statements

H302 Harmful if swallowed 吞食有害

RTECSXH5082000

Signal word Warning

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

Hazard Codes Xn

Risk Statements

R22 Harmful if swallowed 吞咽有害

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE/DU

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1320 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: 6,346,1982

TYPE OF TEST

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - man
DOSE/DURATION           : 11400 ug/kg
TOXIC EFFECTS :
   Behavioral - hallucinations, distorted perceptions
REFERENCE :
   AJPSAO American Journal of Psychiatry.  (American Psychiatric Assoc.,
   Circulation Dept., 1400 K St., NW, Washington, DC 20005)  V.78-    1921-
   Volume(issue)/page/year: 128,1012,1972

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 203 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: 6,346,1982

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - infant
DOSE/DURATION           : 114 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - coma
   Cardiac - arrhythmias (including changes in conduction)
REFERENCE :
   JTCTDW Journal of Toxicology, Clinical Toxicology.  (Marcel Dekker, 270
   Madison Ave., New York, NY 10016)  V.19-    1982-  Volume(issue)/page/year:
   29,527,1991

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 333 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 9(Suppl
   9),1,1987

其他信息

用途二:适用于晕动症、妊娠、放射治疗、手术后等引起的恶心、呕吐、眩晕等。
用途一:晕车药
Sigma Aldrich:523-87-5(sigmaaldrich)
MSDS 信息:N-(2-Diphenylmethoxyethyl)-N,N-dimethylammonium 8-chlorotheophyllinate(523-87-5).msds
MOL 文件:523-87-5.mol