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Home > Fluorides > 150308-80-8
150308-80-8 | L-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-[[(4-methoxyphenyl)methyl]seleno]-
CAS No: 150308-80-8 Catalog No: AG001MHR MDL No:MFCD03788170
Product Description
Catalog Number:
AG001MHR
Chemical Name:
L-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-[[(4-methoxyphenyl)methyl]seleno]-
CAS Number:
150308-80-8
Molecular Formula:
C26H25NO5Se
Molecular Weight:
510.4404
MDL Number:
MFCD03788170
IUPAC Name:
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(4-methoxyphenyl)methylselanyl]propanoic acid
InChI:
InChI=1S/C26H25NO5Se/c1-31-18-12-10-17(11-13-18)15-33-16-24(25(28)29)27-26(30)32-14-23-21-8-4-2-6-19(21)20-7-3-5-9-22(20)23/h2-13,23-24H,14-16H2,1H3,(H,27,30)(H,28,29)/t24-/m0/s1
InChI Key:
XCPAYIZRJRMXBI-DEOSSOPVSA-N
SMILES:
COc1ccc(cc1)C[Se]C[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
631
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
511.09g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
510.459g/mol
Monoisotopic Mass:
511.09g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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