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1225349-89-2 | 3-Piperidinecarboxylic acid, 1-amino-, 1,1-dimethylethyl ester, (3S)-
CAS No: 1225349-89-2 Catalog No: AG0017EI MDL No:MFCD07787222
Product Description
Catalog Number:
AG0017EI
Chemical Name:
3-Piperidinecarboxylic acid, 1-amino-, 1,1-dimethylethyl ester, (3S)-
CAS Number:
1225349-89-2
Molecular Formula:
C10H20N2O2
Molecular Weight:
200.2780
MDL Number:
MFCD07787222
IUPAC Name:
tert-butyl (3S)-1-aminopiperidine-3-carboxylate
InChI:
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)8-5-4-6-12(11)7-8/h8H,4-7,11H2,1-3H3/t8-/m0/s1
InChI Key:
BXHWWPNRUOHACS-QMMMGPOBSA-N
SMILES:
NN1CCC[C@@H](C1)C(=O)OC(C)(C)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
200.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.282g/mol
Monoisotopic Mass:
200.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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