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163981-90-6 | 4-Acridinecarboxylic acid, 9-chloro-
CAS No: 163981-90-6 Catalog No: AG001UKS MDL No:
Product Description
Catalog Number:
AG001UKS
Chemical Name:
4-Acridinecarboxylic acid, 9-chloro-
CAS Number:
163981-90-6
Molecular Formula:
C14H8ClNO2
Molecular Weight:
257.6718
IUPAC Name:
9-chloroacridine-4-carboxylic acid
InChI:
InChI=1S/C14H8ClNO2/c15-12-8-4-1-2-7-11(8)16-13-9(12)5-3-6-10(13)14(17)18/h1-7H,(H,17,18)
InChI Key:
VMKDSNFBFTVNGT-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1nc1ccccc1c2Cl
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.024g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.673g/mol
Monoisotopic Mass:
257.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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