102585-07-9

102585-07-9 structure

102585-07-9 structure

Name: 1-methyl-3-pyrrolidin-1-yl-9H-xanthene-9-carboxylic acid,sulfuric acid
Chemical Name: 1-methyl-3-pyrrolidin-1-yl-9H-xanthene-9-carboxylic acid,sulfuric acid
CAS Number: 102585-07-9
Molecular Formula: C₁₉H₂₁NO₇S
Molecular Weight: 407.43800
Create Date: 2016-05-19 02:56:40
Modify Date: 2024-01-21 14:46:39

Name	1-methyl-3-pyrrolidin-1-yl-9H-xanthene-9-carboxylic acid,sulfuric acid
Synonyms	Xanthene-9-carboxylic acid,1-methyl-3-pyrrolidinyl ester,sulfate AHR 361 1-Methyl-3-pyrrolidinylxanthene-9-carboxylate sulfate

Molecular Formula	C₁₉H₂₁NO₇S
Molecular Weight	407.43800
Exact Mass	407.10400
PSA	132.75000
LogP	4.41040
Vapour Pressure	3.14E-10mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ZD5703200

CHEMICAL NAME :: Xanthene-9-carboxylic acid, 1-methyl-3-pyrrolidinyl ester, sulfate

CAS REGISTRY NUMBER :: 102585-07-9

LAST UPDATED :: 199706

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C19-H19-N-O3.H2-O4-S

MOLECULAR WEIGHT :: 407.47

WISWESSER LINE NOTATION :: T C666 BO IHJ IVO- CT5NTJ A1 &..H2.S-O4

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 :: 600 mg/kg

TOXIC EFFECTS :: Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 2,523,1960

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 205 mg/kg

TOXIC EFFECTS :: Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 2,523,1960