200,000+ products from a single source!
sales@angenechem.com
1312810-39-1 | 1-Piperidinecarboxylic acid, 3-amino-5-methyl-, 1,1-dimethylethyl ester, (3S,5R)-
CAS No: 1312810-39-1 Catalog No: AG000VUQ MDL No:MFCD22373939
Product Description
Catalog Number:
AG000VUQ
Chemical Name:
1-Piperidinecarboxylic acid, 3-amino-5-methyl-, 1,1-dimethylethyl ester, (3S,5R)-
CAS Number:
1312810-39-1
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
MDL Number:
MFCD22373939
IUPAC Name:
tert-butyl (3S,5R)-3-amino-5-methylpiperidine-1-carboxylate
InChI:
InChI=1S/C11H22N2O2/c1-8-5-9(12)7-13(6-8)10(14)15-11(2,3)4/h8-9H,5-7,12H2,1-4H3/t8-,9+/m1/s1
InChI Key:
PLLHWQMECGKRCY-BDAKNGLRSA-N
SMILES:
C[C@@H]1C[C@H](N)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
235
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:
1
Isotope Atom Count:
0
Molecular Weight:
214.309g/mol
Monoisotopic Mass:
214.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.