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141992-49-6 | 1-Acridinecarboxylic acid, 9,10-dihydro-4-methoxy-9-oxo-
CAS No: 141992-49-6 Catalog No: AG001HIN MDL No:
Product Description
Catalog Number:
AG001HIN
Chemical Name:
1-Acridinecarboxylic acid, 9,10-dihydro-4-methoxy-9-oxo-
CAS Number:
141992-49-6
Molecular Formula:
C15H11NO4
Molecular Weight:
269.2521
IUPAC Name:
4-methoxy-9-oxo-10H-acridine-1-carboxylic acid
InChI:
InChI=1S/C15H11NO4/c1-20-11-7-6-9(15(18)19)12-13(11)16-10-5-3-2-4-8(10)14(12)17/h2-7H,1H3,(H,16,17)(H,18,19)
InChI Key:
RZGKCTSDFWAMKX-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1[nH]c1ccccc1c2=O)C(=O)O
NSC Number:
625993
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.256g/mol
Monoisotopic Mass:
269.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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