Home Carbonyls 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)phenyl]propanoic acid

2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)phenyl]propanoic acid

CAS No.:
174213-78-6
Catalog Number:
AG01EKVN
Molecular Formula:
C24H21NO4
Molecular Weight:
387.4278
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Product Description
Catalog Number:
AG01EKVN
Chemical Name:
2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)phenyl]propanoic acid
CAS Number:
174213-78-6
Molecular Formula:
C24H21NO4
Molecular Weight:
387.4278
MDL Number:
MFCD31666631
IUPAC Name:
2-[4-(9H-fluoren-9-ylmethoxycarbonylamino)phenyl]propanoic acid
InChI:
InChI=1S/C24H21NO4/c1-15(23(26)27)16-10-12-17(13-11-16)25-24(28)29-14-22-20-8-4-2-6-18(20)19-7-3-5-9-21(19)22/h2-13,15,22H,14H2,1H3,(H,25,28)(H,26,27)
InChI Key:
LBHWHSFAKSZFLP-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)C(C(=O)O)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
563  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.147g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
387.435g/mol
Monoisotopic Mass:
387.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties