Home Carboxys 1-Piperidinecarboxylic acid, 4-cyano-3-hydroxy-, 1,1-dimethylethyl ester, trans-

1-Piperidinecarboxylic acid, 4-cyano-3-hydroxy-, 1,1-dimethylethyl ester, trans-

CAS No.:
188879-53-0
Catalog Number:
AG002HGD
Molecular Formula:
C11H18N2O3
Molecular Weight:
226.2722
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$253
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Product Description
Catalog Number:
AG002HGD
Chemical Name:
1-Piperidinecarboxylic acid, 4-cyano-3-hydroxy-, 1,1-dimethylethyl ester, trans-
CAS Number:
188879-53-0
Molecular Formula:
C11H18N2O3
Molecular Weight:
226.2722
MDL Number:
MFCD27988120
IUPAC Name:
tert-butyl (3S,4S)-4-cyano-3-hydroxypiperidine-1-carboxylate
InChI:
InChI=1S/C11H18N2O3/c1-11(2,3)16-10(15)13-5-4-8(6-12)9(14)7-13/h8-9,14H,4-5,7H2,1-3H3/t8-,9+/m0/s1
InChI Key:
KUAAPLIYEFPNBA-DTWKUNHWSA-N
SMILES:
N#C[C@H]1CCN(C[C@@H]1O)C(=O)OC(C)(C)C
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
226.132g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.276g/mol
Monoisotopic Mass:
226.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties