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Tofetridine
[CAS# 40173-75-9]

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Identification
Name Tofetridine
Synonyms Tofetridine; Tofetridine [Inn]
Molecular Structure CAS#: 40173-75-9, Tofetridine
Molecular Formula C15H21NO
Molecular Weight 231.34
CAS Registry Number 40173-75-9
SMILES C1=C(OC)C=CC2=C1C3(C(NC2)CCCC3)C
InChI 1S/C15H21NO/c1-15-8-4-3-5-14(15)16-10-11-6-7-12(17-2)9-13(11)15/h6-7,9,14,16H,3-5,8,10H2,1-2H3
InChIKey IQYAWBKZKZRPEQ-UHFFFAOYSA-N
Properties
Density 1.037g/cm3 (Cal.)
Boiling point 346.639°C at 760 mmHg (Cal.)
Flash point 144.132°C (Cal.)
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