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methyl 4-oxopiperidine-3-carboxylate

methyl 4-oxopiperidine-3-carboxylate

CAS: 108554-34-3

Formula: C7H11NO3

SMILES: COC(=O)C1CNCCC1=O

IUPAC: methyl 4-oxopiperidine-3-carboxylate

InChI: InChI=1/C7H11NO3/c1-11-7(10)5-4-8-3-2-6(5)9/h5,8H,2-4H2,1H3

Composition: C (53.49%), H (7.05%), N (8.91%), O (30.54%)

Molar Mass: 157.169

Atom Count: 22

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 157.073893218
Formal Charge 0
FSP3 0.71
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XBNGBGYWMXBQRX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.23
Topological Polar Surface Area 55.4
Polarizability 15.32
Ring Count 1
Rotatable Bond Count 2

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98% <2 Days 108554-34-3 $37.95-$1,081.00$37.95$111.55$339.25$1,081.00
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