Home Carbonyls 2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-methylbenzoic acid

2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-methylbenzoic acid

CAS No.:
885951-04-2
Catalog Number:
AG01DX5S
Molecular Formula:
C23H19NO4
Molecular Weight:
373.4013
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Product Description
Catalog Number:
AG01DX5S
Chemical Name:
2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-methylbenzoic acid
CAS Number:
885951-04-2
Molecular Formula:
C23H19NO4
Molecular Weight:
373.4013
MDL Number:
MFCD02682220
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbenzoic acid
InChI:
InChI=1S/C23H19NO4/c1-14-7-6-12-19(22(25)26)21(14)24-23(27)28-13-20-17-10-4-2-8-15(17)16-9-3-5-11-18(16)20/h2-12,20H,13H2,1H3,(H,24,27)(H,25,26)
InChI Key:
HRZRGCZCULPHNU-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(C)cccc1C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
557  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.131g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
373.408g/mol
Monoisotopic Mass:
373.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties