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372144-02-0 | 3-Amino-3-(1-(tert-butoxycarbonyl)piperidin-4-yl)propanoic acid
CAS No: 372144-02-0 Catalog No: AG0033KV MDL No:MFCD03425240
Product Description
Catalog Number:
AG0033KV
Chemical Name:
3-Amino-3-(1-(tert-butoxycarbonyl)piperidin-4-yl)propanoic acid
CAS Number:
372144-02-0
Molecular Formula:
C13H24N2O4
Molecular Weight:
272.3407
MDL Number:
MFCD03425240
IUPAC Name:
3-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)10(14)8-11(16)17/h9-10H,4-8,14H2,1-3H3,(H,16,17)
InChI Key:
COIKOWZPIUVFDC-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C1CCN(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:
-1.8
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