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101214-43-1 | L-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS No: 101214-43-1 Catalog No: AG0003ZY MDL No:MFCD00062204
Product Description
Catalog Number:
AG0003ZY
Chemical Name:
L-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS Number:
101214-43-1
Molecular Formula:
C28H24N2O6
Molecular Weight:
484.5000
MDL Number:
MFCD00062204
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoate
InChI:
InChI=1S/C28H24N2O6/c31-25-14-15-26(32)30(25)36-27(33)24(16-18-8-2-1-3-9-18)29-28(34)35-17-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23-24H,14-17H2,(H,29,34)/t24-/m0/s1
InChI Key:
VLXHZQQUTCVLGU-DEOSSOPVSA-N
SMILES:
O=C(N[C@H](C(=O)ON1C(=O)CCC1=O)Cc1ccccc1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
802
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
484.163g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
484.508g/mol
Monoisotopic Mass:
484.163g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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