CAS 6027-98-1|HARMALINE HYDROCHLORIDE DIHYDRATE

Introduction:Basic information about CAS 6027-98-1|HARMALINE HYDROCHLORIDE DIHYDRATE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameHARMALINE HYDROCHLORIDE DIHYDRATE
CAS Number6027-98-1Molecular Weight286.75500
Density/Boiling Point426.4ºC at 760 mmHg
Molecular FormulaC13H19ClN2O3Melting Point232-240 °C
MSDSUSAFlash Point211.7ºC

Names

Nameharmaline hydrochloride dihydrate
SynonymMore Synonyms

Chemical & Physical Properties

Boiling Point426.4ºC at 760 mmHg
Melting Point232-240 °C
Molecular FormulaC13H19ClN2O3
Molecular Weight286.75500
Flash Point211.7ºC
Exact Mass286.10800
PSA55.84000
LogP2.65060
InChIKeyLCEKUHFBUFUSSY-UHFFFAOYSA-N
SMILESCOc1ccc2c3c([nH]c2c1)C(C)=NCC3.Cl.O.O
Storage condition−20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MG8750000
CHEMICAL NAME :
Harmaline, hydrochloride, dihydrate
CAS REGISTRY NUMBER :
6027-98-1
LAST UPDATED :
199106
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C13-H14-N2-O.Cl-H.2H2-O
MOLECULAR WEIGHT :
286.79

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
120 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
TRSEAO Transactions of the Royal Society of Edinburgh. (Edinburgh, Scotland) V.1-70, 1783-1979. Volume(issue)/page/year: 47,245,1909
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
TRSEAO Transactions of the Royal Society of Edinburgh. (Edinburgh, Scotland) V.1-70, 1783-1979. Volume(issue)/page/year: 47,245,1909
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
TRSEAO Transactions of the Royal Society of Edinburgh. (Edinburgh, Scotland) V.1-70, 1783-1979. Volume(issue)/page/year: 47,245,1909
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TRSEAO Transactions of the Royal Society of Edinburgh. (Edinburgh, Scotland) V.1-70, 1783-1979. Volume(issue)/page/year: 47,245,1909
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Amphibian - frog
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TRSEAO Transactions of the Royal Society of Edinburgh. (Edinburgh, Scotland) V.1-70, 1783-1979. Volume(issue)/page/year: 47,245,1909

Safety Information

Personal Protective EquipmentEyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard CodesXn,Xi
Risk PhrasesR36/37/38
Safety PhrasesS22-S24/25
RIDADR1544
WGK Germany3
RTECSMG8750000
Packaging GroupIII
Hazard Class6.1(b)
HS Code2933990090

Customs

HS Code2933990090
Summary2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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