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Demethylcotinine
[CAS# 5980-06-3]

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CAS#: 5980-06-3
Product: Demethylcotinine
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Identification
Name Demethylcotinine
Synonyms (5S)-5-(3-Pyridyl)Pyrrolidin-2-One; (5S)-5-(3-Pyridyl)-2-Pyrrolidinone; (5S)-5-(3-Pyridyl)-2-Pyrrolidone
Molecular Structure CAS#: 5980-06-3, Demethylcotinine
Molecular Formula C9H10N2O
Molecular Weight 162.19
CAS Registry Number 5980-06-3
SMILES [C@@H]1(NC(=O)CC1)C2=CC=CN=C2
InChI 1S/C9H10N2O/c12-9-4-3-8(11-9)7-2-1-5-10-6-7/h1-2,5-6,8H,3-4H2,(H,11,12)/t8-/m0/s1
InChIKey FXFANIORDKRCCA-QMMMGPOBSA-N
Properties
Density 1.17g/cm3 (Cal.)
Boiling point 398.167°C at 760 mmHg (Cal.)
Flash point 194.605°C (Cal.)
Market Analysis Reports
List of Reports Available for Demethylcotinine
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