CAS 17692-51-2|Metergoline

Introduction:Basic information about CAS 17692-51-2|Metergoline, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameMetergoline
CAS Number17692-51-2Molecular Weight403.51700
Density1.25g/cm3Boiling Point612.5ºC at 760mmHg
Molecular FormulaC25H29N3O2Melting Point148-150 °C(lit.)
MSDSChineseUSAFlash Point324.2ºC
Symbol
GHS07
Signal WordWarning

Names

Namemetergoline
SynonymMore Synonyms

Metergoline BiologicalActivity

DescriptionMetergoline is a psychoactive drug of the ergoline chemical class which acts as a ligand for various serotonin and dopamine receptors.
Related CatalogSignaling Pathways >>GPCR/G Protein >>5-HT ReceptorSignaling Pathways >>Neuronal Signaling >>5-HT ReceptorResearch Areas >>Neurological Disease

Chemical & Physical Properties

Density1.25g/cm3
Boiling Point612.5ºC at 760mmHg
Melting Point148-150 °C(lit.)
Molecular FormulaC25H29N3O2
Molecular Weight403.51700
Flash Point324.2ºC
Exact Mass403.22600
PSA46.50000
LogP4.39350
Vapour Pressure0mmHg at 25°C
InChIKeyWZHJKEUHNJHDLS-QTGUNEKASA-N
SMILESCN1CC(CNC(=O)OCc2ccccc2)CC2c3cccc4c3c(cn4C)CC21
Storage condition−20°C
Water Solubility0.1 M HCl: 1.4 mg/mL

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FA1070000
CHEMICAL NAME :
Carbamic acid, (((8-beta)-1,6-dimethylergolin-8-yl)methyl)-, benzyl ester
CAS REGISTRY NUMBER :
17692-51-2
LAST UPDATED :
199703
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C25-H29-N3-O2
MOLECULAR WEIGHT :
403.57
WISWESSER LINE NOTATION :
T C6656 1A P GN LNTT&&J E1MVO1R& G1 L1

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 :
430 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 207,421,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
85 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 207,421,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
21200 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4176182
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
20 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 207,421,1965 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
1200 ug/kg
SEX/DURATION :
lactating female 5 day(s) post-birth
TOXIC EFFECTS :
Reproductive - Maternal Effects - postpartum Reproductive - Maternal Effects - other effects
REFERENCE :
OBGNAS Obstetrics and Gynecology. (Elsevier Science Pub. Co., Inc., 52 Vanderbilt Ave., New York, NY 10017) V.1- 1953- Volume(issue)/page/year: 51,113,1978

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302-H312-H332
Precautionary StatementsP280
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard CodesXn: Harmful;
Risk PhrasesR20/21/22
Safety PhrasesS36
RIDADRNONH for all modes of transport
WGK Germany3
RTECSFA1070000

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Synonyms

Metergoline,[(8β)-1,6-Dimethylergolin-8-yl)methyl]carbamicacidphenylmethylester
EINECS 241-686-3
MFCD00153829
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