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Home > Fluorides > 201048-68-2
201048-68-2 | L-Ornithine, N5-[(9H-fluoren-9-ylmethoxy)carbonyl]-N2-[(phenylmethoxy)carbonyl]-
CAS No: 201048-68-2 Catalog No: AG002D66 MDL No:MFCD00237358
Product Description
Catalog Number:
AG002D66
Chemical Name:
L-Ornithine, N5-[(9H-fluoren-9-ylmethoxy)carbonyl]-N2-[(phenylmethoxy)carbonyl]-
CAS Number:
201048-68-2
Molecular Formula:
C28H28N2O6
Molecular Weight:
488.5317
MDL Number:
MFCD00237358
IUPAC Name:
(2S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(phenylmethoxycarbonylamino)pentanoic acid
InChI:
InChI=1S/C28H28N2O6/c31-26(32)25(30-28(34)35-17-19-9-2-1-3-10-19)15-8-16-29-27(33)36-18-24-22-13-6-4-11-20(22)21-12-5-7-14-23(21)24/h1-7,9-14,24-25H,8,15-18H2,(H,29,33)(H,30,34)(H,31,32)/t25-/m0/s1
InChI Key:
JEFQVIBFPUQDGA-VWLOTQADSA-N
SMILES:
O=C(OCC1c2ccccc2c2c1cccc2)NCCC[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Properties
Complexity:
718
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
488.195g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
488.54g/mol
Monoisotopic Mass:
488.195g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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