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Dotarizine
[CAS# 84625-59-2]

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Identification
Name Dotarizine
Synonyms 1-(Diphenylmethyl)-4-(3-(2-Phenyl-1,3-Dioxolan-2-Yl)Propyl)Piperazine; Dotarizine; Dotarizina [Spanish]
Molecular Structure CAS#: 84625-59-2, Dotarizine
Molecular Formula C29H34N2O2
Molecular Weight 442.60
CAS Registry Number 84625-59-2
SMILES C1=CC=CC=C1C5(CCCN4CCN(C(C2=CC=CC=C2)C3=CC=CC=C3)CC4)OCCO5
InChI 1S/C29H34N2O2/c1-4-11-25(12-5-1)28(26-13-6-2-7-14-26)31-21-19-30(20-22-31)18-10-17-29(32-23-24-33-29)27-15-8-3-9-16-27/h1-9,11-16,28H,10,17-24H2
InChIKey LRMJAFKKJLRDLE-UHFFFAOYSA-N
Properties
Density 1.123g/cm3 (Cal.)
Boiling point 557.408°C at 760 mmHg (Cal.)
Flash point 147.917°C (Cal.)
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