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64894-83-3 | Benzoic acid, 4-(9-acridinylamino)-
CAS No: 64894-83-3 Catalog No: AG003ALC MDL No:
Product Description
Catalog Number:
AG003ALC
Chemical Name:
Benzoic acid, 4-(9-acridinylamino)-
CAS Number:
64894-83-3
Molecular Formula:
C20H14N2O2
Molecular Weight:
314.3374
IUPAC Name:
4-(acridin-9-ylamino)benzoic acid
InChI:
InChI=1S/C20H14N2O2/c23-20(24)13-9-11-14(12-10-13)21-19-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)19/h1-12H,(H,21,22)(H,23,24)
InChI Key:
FNNMCOQMDNRQHG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)Nc1c2ccccc2nc2c1cccc2
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.106g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.344g/mol
Monoisotopic Mass:
314.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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