Product Name

  • Name

    Irinotecan hydrochloride trihydrate

  • EINECS 603-967-2
  • CAS No. 136572-09-3
  • Article Data2
  • CAS DataBase
  • Density ==
  • Solubility Soluble in DMSO at 100mg/ml. Soluble in water at 25mg/ml with warming
  • Melting Point 250-256 °C (dec.)
  • Formula C33H45ClN4O9
  • Boiling Point 873.4 °C at 760 mmHg
  • Molecular Weight 677.195
  • Flash Point 482 °C
  • Transport Information
  • Appearance Pale yellow to yellow crystalline powder
  • Safety 20/21-22
  • Risk Codes 22
  • Molecular Structure Molecular Structure of 136572-09-3 (Irinotecan hydrochloride trihydrate)
  • Hazard Symbols
  • Synonyms [1,4'-Bipiperidine]-1'-carboxylicacid,(4S)-4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-ylester, monohydrochloride, trihydrate (9CI);[1,4'-Bipiperidine]-1'-carboxylicacid,4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-ylester, monohydrochloride, trihydrate, (S)-;Irinotecan hydrochloridehydrate;
  • PSA 141.89000
  • LogP 4.57600

Synthetic route

irinotecan hydrochloirde
100286-90-6

irinotecan hydrochloirde

irinotecan hydrochloride trihydrate
136572-09-3

irinotecan hydrochloride trihydrate

Conditions
ConditionsYield
With hydrogenchloride; water In ethanol at 75 - 80℃;87%
With water In ethanol Heating / reflux;

Irinotecan hydrochloride trihydrate Chemical Properties

Molecular structure of Irinotecan hydrochloride trihydrate (CAS NO.136572-09-3) is:

Product Name: Irinotecan hydrochloride trihydrate
CAS Registry Number: 136572-09-3
Molecular Weight: 677.1848 [g/mol]
Molecular Formula: C33H45ClN4O9
H-Bond Donor: 5
H-Bond Acceptor: 11
Melting Point: 250-256 °C (dec.)
 Flash Point: 482 °C
Enthalpy of Vaporization: 132.98 kJ/mol
Boiling Point: 873.4 °C at 760 mmHg
Vapour Pressure: 1.31E-32 mmHg at 25°C
Product Categories: API

Irinotecan hydrochloride trihydrate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 40mg/kg (40mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 953, 1995.
mouse LD50 intravenous 132mg/kg (132mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 953, 1995.
mouse LD50 oral 1045mg/kg (1045mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 953, 1995.
rat LD50 intravenous 83600ug/kg (83.6mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 953, 1995.
rat LD50 oral 867mg/kg (867mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 953, 1995.

Irinotecan hydrochloride trihydrate Safety Profile

A poison by intravenous route. Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx, HCl, and Cl−.

Irinotecan hydrochloride trihydrate Specification

 Irinotecan hydrochloride trihydrate , its cas register number is 136572-09-3. It also can be called (S)-[1,4'-Bipiperidine]-1'-carboxylic acid 4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl ester hydrochloride trihydrate ; Irinotecan hydrochloride [USAN:JAN] ; (+)-7-Ethyl-10-hydroxycamptothecine 10-(1,4'-bipiperidine)-1'-carboxylate, monohydrochloride, trihydrate ; Camptosar ; Irinotecan HCl ; (1,4'-Bipiperidine)-1'-carboxylic acid, 4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano(3',4':6,7)indolizino(1,2-b)quinolin-9-yl ester, monohydrochloride, trihydrate, (S)- .

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