Chelerythrine chloride

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Names

[ CAS No. ]:
3895-92-9

[ Name ]:
Chelerythrine chloride

[Synonym ]:
[1,3]Benzodioxolo[5,6-c]phenanthridinium, 1,2-dimethoxy-12-methyl-, chloride (1:1)
MFCD00060717
1,2-Dimethoxy-12-methyl[1,3]dioxolo[4,5]benzo[1,2-c]phenanthridin-12-iumchlorid
1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridiniumchloride
1,2-Dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium chloride
1,2-Dimethoxy-N-methyl(1,3)benzodioxolo(5,6-c)phenanthridinium chloride
1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium,chloride
Chelerythrine chloride
EINECS 223-444-9

Chemical & Physical Properties

[ Density]:
1.36g/cm3

[ Boiling Point ]:
711.4ºC at 760 mmHg

[ Melting Point ]:
195-205ºC

[ Molecular Formula ]:
C21H18ClNO4

[ Molecular Weight ]:
383.825

[ Flash Point ]:
219.3ºC

[ Exact Mass ]:
383.092438

[ PSA ]:
40.80000

[ LogP ]:
0.72060

[ Index of Refraction ]:
1.681

[ Storage condition ]:
−20°C

[ Water Solubility ]:
DMSO: ≥10 mg/mL

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FL9200000
CHEMICAL NAME :
Chelerythrine, chloride
CAS REGISTRY NUMBER :
3895-92-9
LAST UPDATED :
198605
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H18-N-O4.Cl

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 :
95 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 43,161,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
18500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 43,161,1981

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H312-H315-H319-H332-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S36/37

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
FL9200000

[ HS Code ]:
2933990090

Synthetic Route

Precursor & DownStream

Precursor

  • Dihydrochelerythrine
  • 6-Oxochelerythrine
  • 1,2-dimethoxy-12-methyl-5,6,12,13-tetrahydro-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine
  • Norchelerythrine
  • ammonium malonate
  • methyl 2,3-dimethoxy-6-iodobenzoate

DownStream

  • Angoline
  • 6-Oxochelerythrine
  • Dihydrochelerythrine
  • N-[6-(2-HYDROXY-3,4-DIMETHOXYPHENYL)NAPHTHO[2,3-D][1,3]DIOXOL-5-YL]-N-METHYLFORMAMIDE

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. 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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Related Compounds

  • Chelerythrine chloride
  • Sanguinarine chloride mixt. with chelerythrine chloride
  • SANGUINARINE
  • dodecanoyl chloride,hydrofluoride
  • Ethanesulfonyl chloride
  • YTTRIUM CHLORIDE HEXAHYDRATE