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177702-21-5 | 4-Piperidineacetic acid, α-amino-1-[(1,1-dimethylethoxy)carbonyl]-, (αR)-
CAS No: 177702-21-5 Catalog No: AG0025GQ MDL No:
Product Description
Catalog Number:
AG0025GQ
Chemical Name:
4-Piperidineacetic acid, α-amino-1-[(1,1-dimethylethoxy)carbonyl]-, (αR)-
CAS Number:
177702-21-5
Molecular Formula:
C12H22N2O4
Molecular Weight:
258.3141
IUPAC Name:
(2R)-2-amino-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid
InChI:
InChI=1S/C12H22N2O4/c1-12(2,3)18-11(17)14-6-4-8(5-7-14)9(13)10(15)16/h8-9H,4-7,13H2,1-3H3,(H,15,16)/t9-/m1/s1
InChI Key:
UPEUKKCILASJSH-SECBINFHSA-N
SMILES:
N[C@@H](C(=O)O)C1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
258.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.318g/mol
Monoisotopic Mass:
258.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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