Home Carboxys 5-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]furan-3-carboxylic acid

5-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]furan-3-carboxylic acid

CAS No.:
1936714-49-6
Catalog Number:
AG01BK4P
Molecular Formula:
C21H17NO5
Molecular Weight:
363.3634
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Product Description
Catalog Number:
AG01BK4P
Chemical Name:
5-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]furan-3-carboxylic acid
CAS Number:
1936714-49-6
Molecular Formula:
C21H17NO5
Molecular Weight:
363.3634
MDL Number:
MFCD31559746
IUPAC Name:
5-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]furan-3-carboxylic acid
InChI:
InChI=1S/C21H17NO5/c23-20(24)13-9-14(26-11-13)10-22-21(25)27-12-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-9,11,19H,10,12H2,(H,22,25)(H,23,24)
InChI Key:
FJRPHUQMQXSZES-UHFFFAOYSA-N
SMILES:
O=C(NCc1occ(c1)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
531  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.111g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
363.369g/mol
Monoisotopic Mass:
363.111g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties