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1227919-32-5

1227919-32-5 | Carbamic acid, N-[(3R,5R)-5-methyl-3-piperidinyl]-, 1,1-dimethylethyl ester

CAS No: 1227919-32-5 Catalog No: AG000JGI MDL No:MFCD18072963

Product Description

Catalog Number:
AG000JGI
Chemical Name:
Carbamic acid, N-[(3R,5R)-5-methyl-3-piperidinyl]-, 1,1-dimethylethyl ester
CAS Number:
1227919-32-5
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
MDL Number:
MFCD18072963
IUPAC Name:
tert-butyl N-[(3R,5R)-5-methylpiperidin-3-yl]carbamate
InChI:
InChI=1S/C11H22N2O2/c1-8-5-9(7-12-6-8)13-10(14)15-11(2,3)4/h8-9,12H,5-7H2,1-4H3,(H,13,14)/t8-,9-/m1/s1
InChI Key:
CNALVHVMBXLLIY-RKDXNWHRSA-N
SMILES:
C[C@H]1CNC[C@@H](C1)NC(=O)OC(C)(C)C

Properties

Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
214.168g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
214.309g/mol
Monoisotopic Mass:
214.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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