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1820575-73-2 | Propanoic acid, 3-cyano-2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2R)-
CAS No: 1820575-73-2 Catalog No: AG0023AT MDL No:MFCD01861377
Product Description
Catalog Number:
AG0023AT
Chemical Name:
Propanoic acid, 3-cyano-2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2R)-
CAS Number:
1820575-73-2
Molecular Formula:
C19H16N2O4
Molecular Weight:
336.3413
MDL Number:
MFCD01861377
IUPAC Name:
(2R)-3-cyano-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C19H16N2O4/c20-10-9-17(18(22)23)21-19(24)25-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-17H,9,11H2,(H,21,24)(H,22,23)/t17-/m1/s1
InChI Key:
FJSOTHAUCCEZLI-QGZVFWFLSA-N
SMILES:
N#CC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
533
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
336.111g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
336.347g/mol
Monoisotopic Mass:
336.111g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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