Home Carbonyls 5-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-fluorobenzoic acid

5-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-fluorobenzoic acid

CAS No.:
1341822-36-3
Catalog Number:
AG01AJLV
Molecular Formula:
C22H16FNO4
Molecular Weight:
377.3651
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Product Description
Catalog Number:
AG01AJLV
Chemical Name:
5-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-fluorobenzoic acid
CAS Number:
1341822-36-3
Molecular Formula:
C22H16FNO4
Molecular Weight:
377.3651
MDL Number:
MFCD17170513
IUPAC Name:
5-(9H-fluoren-9-ylmethoxycarbonylamino)-2-fluorobenzoic acid
InChI:
InChI=1S/C22H16FNO4/c23-20-10-9-13(11-18(20)21(25)26)24-22(27)28-12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,19H,12H2,(H,24,27)(H,25,26)
InChI Key:
BNYGAHXKRAPKLL-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(c(c1)C(=O)O)F)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:
377.106g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
377.371g/mol
Monoisotopic Mass:
377.106g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties