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2480-93-5 | L-Ornithine, N2-[(1,1-dimethylethoxy)carbonyl]-N5-[(phenylmethoxy)carbonyl]-
CAS No: 2480-93-5 Catalog No: AG002PHC MDL No:MFCD00038259
Product Description
Catalog Number:
AG002PHC
Chemical Name:
L-Ornithine, N2-[(1,1-dimethylethoxy)carbonyl]-N5-[(phenylmethoxy)carbonyl]-
CAS Number:
2480-93-5
Molecular Formula:
C18H26N2O6
Molecular Weight:
366.4088
MDL Number:
MFCD00038259
IUPAC Name:
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylmethoxycarbonylamino)pentanoic acid
InChI:
InChI=1S/C18H26N2O6/c1-18(2,3)26-17(24)20-14(15(21)22)10-7-11-19-16(23)25-12-13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,19,23)(H,20,24)(H,21,22)/t14-/m0/s1
InChI Key:
QYYCZJUFHDLLOJ-AWEZNQCLSA-N
SMILES:
O=C(OCc1ccccc1)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
366.179g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
366.414g/mol
Monoisotopic Mass:
366.179g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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