Product Name: Trimol (CAS NO.16378-22-6)
Molecular Formula: C22H25N•ClH
Molecular Weight: 339.94g/mol
Mol File: 16378-22-6.mol
Boiling point: 434.5 °C at 760mmHg
Flash Point: 191.7°C
Density: 1.068g/cm3
H-Bond Donor: 1
H-Bond Acceptor: 1
Structure Descriptors of Trimol (CAS NO.16378-22-6):
Canonical SMILES: CCN1CCC(=C2C3=CC=CC=C3CCC4=CC=CC=C42)C1C.Cl
InChI: InChI=1S/C22H25N.ClH/c1-3-23-15-14-19(16(23)2)22-20-10-6-4-8-17(20)12-13-18-9-5-7-11-21(18)22;/h4-11,16H,3,12-15H2,1-2H3;1H
InChIKey: PLJNHZOEOXGWIR-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LD50 | intravenous | 12500ug/kg (12.5mg/kg) | Kiso to Rinsho. Clinical Report. Vol. 6, Pg. 941, 1972. | |
dog | LD50 | oral | 195mg/kg (195mg/kg) | Kiso to Rinsho. Clinical Report. Vol. 6, Pg. 941, 1972. | |
mouse | LD50 | intraperitoneal | 78mg/kg (78mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 961, 1972. | |
mouse | LD50 | intravenous | 19mg/kg (19mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 467, 1973. | |
mouse | LD50 | oral | 127mg/kg (127mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 961, 1972. | |
mouse | LD50 | subcutaneous | 91mg/kg (91mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 961, 1972. | |
rabbit | LD50 | intravenous | 6200ug/kg (6.2mg/kg) | Kiso to Rinsho. Clinical Report. Vol. 6, Pg. 941, 1972. | |
rabbit | LD50 | oral | 383mg/kg (383mg/kg) | Kiso to Rinsho. Clinical Report. Vol. 6, Pg. 941, 1972. | |
rat | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 467, 1973. | |
rat | LD50 | intravenous | 16mg/kg (16mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 467, 1973. | |
rat | LD50 | oral | 600mg/kg (600mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 467, 1973. | |
rat | LD50 | subcutaneous | 330mg/kg (330mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 961, 1972. |
Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx and HCl.
Trimol ,its CAS NO. is 16378-22-6,the synonyms is Piroheptine HCl ; Piroheptine hydrochloride ; Pyrrolidine, 3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-1-ethyl-2-methyl-, hydrochloride .
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