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16881-42-8 | L-Glutamine, N2-[(phenylmethoxy)carbonyl]-, 1,1-dimethylethyl ester
CAS No: 16881-42-8 Catalog No: AG001YBT MDL No:MFCD00191092
Product Description
Catalog Number:
AG001YBT
Chemical Name:
L-Glutamine, N2-[(phenylmethoxy)carbonyl]-, 1,1-dimethylethyl ester
CAS Number:
16881-42-8
Molecular Formula:
C17H24N2O5
Molecular Weight:
336.3829
MDL Number:
MFCD00191092
IUPAC Name:
tert-butyl (2S)-5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoate
InChI:
InChI=1S/C17H24N2O5/c1-17(2,3)24-15(21)13(9-10-14(18)20)19-16(22)23-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H2,18,20)(H,19,22)/t13-/m0/s1
InChI Key:
UCFPQVRNAZMYMC-ZDUSSCGKSA-N
SMILES:
O=C(N[C@H](C(=O)OC(C)(C)C)CCC(=O)N)OCc1ccccc1
EC Number:
240-912-8
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
336.169g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
336.388g/mol
Monoisotopic Mass:
336.169g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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