Home Other Building Blocks 2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-FLUORO-BENZOIC ACID

2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-FLUORO-BENZOIC ACID

CAS No.:
1485218-64-1
Catalog Number:
AG01DYSU
Molecular Formula:
C22H16FNO4
Molecular Weight:
377.3651
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Product Description
Catalog Number:
AG01DYSU
Chemical Name:
2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-FLUORO-BENZOIC ACID
CAS Number:
1485218-64-1
Molecular Formula:
C22H16FNO4
Molecular Weight:
377.3651
MDL Number:
MFCD17170499
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-fluorobenzoic acid
InChI:
InChI=1S/C22H16FNO4/c23-19-11-5-10-17(21(25)26)20(19)24-22(27)28-12-18-15-8-3-1-6-13(15)14-7-2-4-9-16(14)18/h1-11,18H,12H2,(H,24,27)(H,25,26)
InChI Key:
ZMRIBALTOWHSDV-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(F)cccc1C(=O)O)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:
4.8  
Properties