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220497-96-1 | (2R)-2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]decanoic acid
CAS No: 220497-96-1 Catalog No: AG0039G9 MDL No:
Product Description
Catalog Number:
AG0039G9
Chemical Name:
(2R)-2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]decanoic acid
CAS Number:
220497-96-1
Molecular Formula:
C25H31NO4
Molecular Weight:
409.5179
IUPAC Name:
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)decanoic acid
InChI:
InChI=1S/C25H31NO4/c1-2-3-4-5-6-7-16-23(24(27)28)26-25(29)30-17-22-20-14-10-8-12-18(20)19-13-9-11-15-21(19)22/h8-15,22-23H,2-7,16-17H2,1H3,(H,26,29)(H,27,28)/t23-/m1/s1
InChI Key:
LSMLSLHVRMSYPT-HSZRJFAPSA-N
SMILES:
CCCCCCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
409.225g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
409.526g/mol
Monoisotopic Mass:
409.225g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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