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1977-10-2

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Basic Information
CAS No.: 1977-10-2
Name: loxapine
Article Data: 8
Molecular Structure:
Molecular Structure of 1977-10-2 (loxapine)
Formula: C18H18 Cl N3 O
Molecular Weight: 327.813
Synonyms: 2-Chloro-11-(4-methyl-1-piperazinyl)dibenz[b,f][1,4]oxazepine;2-Chloro-11-(4-methylpiperazino)dibenz[b,f][1,4]oxazepine; CL 62362;Cloxazepine; HF 3170; LW 3170; Loxapin; Loxapine; Loxitane IM; Oxilapine; S805; SUM 3170
Density: 1.31g/cm3
Melting Point: 109-110°
Boiling Point: 458.6°Cat760mmHg
Flash Point: 231.1°C
Safety: Poison by ingestion, intraperitoneal, subcutaneous, and intravenous routes. Experimental teratogenic and reproductive effects. A tranquilizer. Many dibenz-azepine compounds have central nervous system effects. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
PSA: 28.07000
LogP: 3.08280
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Chemistry

Product Name: Dibenzacepin (CAS NO.1977-10-2)


Molecular Formula: C18H18ClN3O
Molecular Weight: 327.84g/mol
Mol File: 1977-10-2.mol
Einecs: 217-835-3
Boiling point: 458.6 °C at 760 mmHg
Flash Point: 231.1 °C
Density: 1.31 g/cm3
Surface Tension: 48.5 dyne/cm
Enthalpy of Vaporization: 71.89 kJ/mol
Vapour Pressure: 1.36E-08 mmHg at 25°C
XLogP3-AA: 3.1
H-Bond Donor: 0
H-Bond Acceptor: 4
Structure Descriptors of Dibenzacepin (CAS NO.1977-10-2):
  IUPAC Name: 8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,5]benzoxazepine
  Canonical SMILES: CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl
  InChI: InChI=1S/C18H18ClN3O/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3 
  InChIKey: XJGVXQDUIWGIRW-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD subcutaneous > 50mg/kg (50mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

KIDNEY, URETER, AND BLADDER: OTHER CHANGES		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 131, 1970.
dog LD subcutaneous > 50mg/kg (50mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

GASTROINTESTINAL: NAUSEA OR VOMITING		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 131, 1970.
guinea pig LDLo subcutaneous 100mg/kg (100mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

BEHAVIORAL: REGIDITY

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 131, 1970.
mouse LD50 intraperitoneal 27mg/kg (27mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 79, 1972.
mouse LD50 intravenous 22mg/kg (22mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.
mouse LD50 oral 40mg/kg (40mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 79, 1972.
mouse LD50 subcutaneous 53mg/kg (53mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.
rabbit LDLo subcutaneous 50mg/kg (50mg/kg) SENSE ORGANS AND SPECIAL SENSES: MIOSIS (PUPILLARY CONSTRICTION): EYE

SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 131, 1970.
rat LD50 intraperitoneal 35mg/kg (35mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.
rat LD50 intravenous 18mg/kg (18mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.
rat LD50 oral 151mg/kg (151mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.
rat LD50 subcutaneous 350mg/kg (350mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 293, 1970.

Safety Profile

Poison by ingestion, intraperitoneal, subcutaneous, and intravenous routes. Experimental teratogenic and reproductive effects. A tranquilizer. Many dibenz-azepine compounds have central nervous system effects. When heated to decomposition it emits very toxic fumes of Cl− and NOx.

Specification

 Dibenzacepin ,its CAS NO. is 1977-10-2,the synonyms is  2-Chloro-11-(4-methyl-1-piperazinyl)dibenz(b,f)(1,4)oxazepine ; 2-Chloro-11-(4-methylpiperazino)dibenzo(b,f)(1,4)oxazepine ; BRN 0626753 ; CL 62362 ; Cloxazepine ; Dibenz(b,f)(1,4)oxazepine, 2-chloro-11-(4-methyl-1-piperazinyl)- ; EINECS 217-835-3 ; HF 3170 ; HSDB 3111 ; Hydrofluoride 3170 ; LW 3170 ; Lossapina ; Oxilapine ; S 805 ; SUM 3170 ; UNII-LER583670J .