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3-[(dimethylamino)methylidene]-1-methylpiperidin-4-one

3-[(dimethylamino)methylidene]-1-methylpiperidin-4-one

CAS: 66521-58-2

Formula: C9H16N2O

SMILES: CN(C)C=C1CN(C)CCC1=O

IUPAC: 3-[(dimethylamino)methylidene]-1-methylpiperidin-4-one

InChI: InChI=1S/C9H16N2O/c1-10(2)6-8-7-11(3)5-4-9(8)12/h6H,4-5,7H2,1-3H3

Composition: C (64.25%), H (9.59%), N (16.65%), O (9.51%)

Molar Mass: 168.24

Atom Count: 28

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 168.126263143
Formal Charge 0
FSP3 0.67
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey DCAZINFOTIWSET-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.55
Topological Polar Surface Area 23.55
Polarizability 19.07
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 66521-58-2 $258.75-$902.75$258.75$902.75
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