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Home > Fluorides > 128107-47-1
128107-47-1 | D-Serine, O-(1,1-dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
CAS No: 128107-47-1 Catalog No: AG000XT4 MDL No:MFCD00077071
Product Description
Catalog Number:
AG000XT4
Chemical Name:
D-Serine, O-(1,1-dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
CAS Number:
128107-47-1
Molecular Formula:
C22H25NO5
Molecular Weight:
383.4376
MDL Number:
MFCD00077071
IUPAC Name:
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(2-methylpropan-2-yl)oxy]propanoic acid
InChI:
InChI=1S/C22H25NO5/c1-22(2,3)28-13-19(20(24)25)23-21(26)27-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,23,26)(H,24,25)/t19-/m1/s1
InChI Key:
REITVGIIZHFVGU-LJQANCHMSA-N
SMILES:
O=C(N[C@@H](C(=O)O)COC(C)(C)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
536
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
383.173g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
383.444g/mol
Monoisotopic Mass:
383.173g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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