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1255666-24-0 | 4-Piperidinepropanoic acid, α-amino-1-[(1,1-dimethylethoxy)carbonyl]-
CAS No: 1255666-24-0 Catalog No: AG000NVU MDL No:MFCD09756562
Product Description
Catalog Number:
AG000NVU
Chemical Name:
4-Piperidinepropanoic acid, α-amino-1-[(1,1-dimethylethoxy)carbonyl]-
CAS Number:
1255666-24-0
Molecular Formula:
C13H24N2O4
Molecular Weight:
272.3407
MDL Number:
MFCD09756562
IUPAC Name:
2-amino-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanoic acid
InChI:
InChI=1S/C13H24N2O4/c1-13(2,3)19-12(18)15-6-4-9(5-7-15)8-10(14)11(16)17/h9-10H,4-8,14H2,1-3H3,(H,16,17)
InChI Key:
JLCGFHQWQKGPIV-UHFFFAOYSA-N
SMILES:
OC(=O)C(CC1CCN(CC1)C(=O)OC(C)(C)C)N
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.174g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.345g/mol
Monoisotopic Mass:
272.174g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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