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tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

CAS: 181269-69-2

Formula: C11H19NO3

SMILES: CC1CN(CCC1=O)C(=O)OC(C)(C)C

IUPAC: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

InChI: InChI=1/C11H19NO3/c1-8-7-12(6-5-9(8)13)10(14)15-11(2,3)4/h8H,5-7H2,1-4H3

Composition: C (61.95%), H (8.98%), N (6.57%), O (22.50%)

Molar Mass: 213.277

Atom Count: 34

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 213.136493476
Formal Charge 0
FSP3 0.82
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey VWSBNWIPICCWAM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.74
Topological Polar Surface Area 46.61
Polarizability 22.26
Ring Count 1
Rotatable Bond Count 2

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97% <7 Days 181269-69-2 $14.96-$835.89$14.96$18.70$42.08$167.37$835.89
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97% <7 Days 181269-69-2 $6.21-$192.51$6.21$7.25$17.60$25.88$59.00$192.51
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97% <6 Days 181269-69-2 $5.75-$483.00$5.75$8.05$13.80$21.85$50.60$483.00
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