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Home > Fluorides > 138775-49-2
138775-49-2 | Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-hydroxy-
CAS No: 138775-49-2 Catalog No: AG0019JS MDL No:MFCD02682298
Product Description
Catalog Number:
AG0019JS
Chemical Name:
Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-hydroxy-
CAS Number:
138775-49-2
Molecular Formula:
C24H21NO5
Molecular Weight:
403.4272
MDL Number:
MFCD02682298
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-hydroxyphenyl)propanoic acid
InChI:
InChI=1S/C24H21NO5/c26-16-7-5-6-15(12-16)13-22(23(27)28)25-24(29)30-14-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-12,21-22,26H,13-14H2,(H,25,29)(H,27,28)
InChI Key:
QTAKQPPYEQCJTJ-UHFFFAOYSA-N
SMILES:
O=C(N[C@H](C(=O)O)Cc1cccc(c1)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
588
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.142g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
403.434g/mol
Monoisotopic Mass:
403.142g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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