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benzyl 4-methylidenepiperidine-1-carboxylate

benzyl 4-methylidenepiperidine-1-carboxylate

CAS: 138163-12-9

Formula: C14H17NO2

SMILES: C=C1CCN(CC1)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 4-methylidenepiperidine-1-carboxylate

InChI: InChI=1S/C14H17NO2/c1-12-7-9-15(10-8-12)14(16)17-11-13-5-3-2-4-6-13/h2-6H,1,7-11H2

Composition: C (72.70%), H (7.41%), N (6.06%), O (13.83%)

Molar Mass: 231.295

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 231.125928791
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FQLKVNIQHUASLU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.96
Topological Polar Surface Area 29.54
Polarizability 25.99
Ring Count 2
Rotatable Bond Count 3

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98% <6 Days 138163-12-9 $17.25-$70.15$17.25$26.45$37.95$51.75$70.15
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95% <5 Days 138163-12-9 $554.00-$924.00$554.00$646.00$924.00
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