CAS 11032-41-0|dihydroergotamine mesylate

Introduction：Basic information about CAS 11032-41-0|dihydroergotamine mesylate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Synonyms

Common Name	dihydroergotamine mesylate
CAS Number	11032-41-0	Molecular Weight	679.783
Density	/	Boiling Point	/
Molecular Formula	C₃₄H₄₁N₅O₈S	Melting Point	/
MSDS	/	Flash Point	/

Names

Name	dihydroergotamine mesylate
Synonym	More Synonyms

Chemical & Physical Properties

Molecular Formula	C₃₄H₄₁N₅O₈S
Molecular Weight	679.783
Exact Mass	679.267578
PSA	180.96000
LogP	2.87050
Appearance of Characters	powder \| white
InChIKey	ADYPXRFPBQGGAH-UHFFFAOYSA-N
SMILES	CN1CC(C(=O)NC2(C)OC3(O)C4CCCN4C(=O)C(Cc4ccccc4)N3C2=O)CC2c3cccc4[nH]cc(c34)CC21.CS(=O)(=O)O
Water Solubility	methanol: 21 mg/mL

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KE8775000

CHEMICAL NAME :: Ergotoxine, dihydro-

CAS REGISTRY NUMBER :: 11032-41-0

LAST UPDATED :: 199509

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 71 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 31,53,1968

Safety Information

Hazard Codes	Xn: Harmful;
Risk Phrases	20/21/22
Safety Phrases	36
WGK Germany	3
RTECS	KE7920000

Synonyms

ergotaman, 9,10-dihydro-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(phenylmethyl)-, (5α,5'α,8α)-, methanesulfonate (1:1) (salt)

Ergotaman, 9,10-dihydro-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(phenylmethyl)-, (5'α)-, methanesulfonate (1:1) (salt)

(5α,5'α,8α)-5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman methanesulfonate (1:1)

(5'α)-5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman methanesulfonate (1:1)

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