Home Carboxys 9-Chloro-5,6,7,8-tetrahydroacridine-3-carboxylic acid

9-Chloro-5,6,7,8-tetrahydroacridine-3-carboxylic acid

CAS No.:
902586-59-8
Catalog Number:
AG00IG1X
Molecular Formula:
C14H12ClNO2
Molecular Weight:
261.7036
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Product Description
Catalog Number:
AG00IG1X
Chemical Name:
9-Chloro-5,6,7,8-tetrahydroacridine-3-carboxylic acid
CAS Number:
902586-59-8
Molecular Formula:
C14H12ClNO2
Molecular Weight:
261.7036
MDL Number:
MFCD14779907
IUPAC Name:
9-chloro-5,6,7,8-tetrahydroacridine-3-carboxylic acid
InChI:
InChI=1S/C14H12ClNO2/c15-13-9-3-1-2-4-11(9)16-12-7-8(14(17)18)5-6-10(12)13/h5-7H,1-4H2,(H,17,18)
InChI Key:
WBIKDLIOIPPDKH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)nc1c(c2Cl)CCCC1
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.056g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.705g/mol
Monoisotopic Mass:
261.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties