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1555-11-9 | 6H-Cyclohepta[b]quinoline-11-carboxylic acid, 2-fluoro-7,8,9,10-tetrahydro-
CAS No: 1555-11-9 Catalog No: AG001NYW MDL No:MFCD01313262
Product Description
Catalog Number:
AG001NYW
Chemical Name:
6H-Cyclohepta[b]quinoline-11-carboxylic acid, 2-fluoro-7,8,9,10-tetrahydro-
CAS Number:
1555-11-9
Molecular Formula:
C15H14FNO2
Molecular Weight:
259.2756
MDL Number:
MFCD01313262
IUPAC Name:
2-fluoro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid
InChI:
InChI=1S/C15H14FNO2/c16-9-6-7-13-11(8-9)14(15(18)19)10-4-2-1-3-5-12(10)17-13/h6-8H,1-5H2,(H,18,19)
InChI Key:
HBSUFSHHGHJZSE-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(C(=O)O)c1c(n2)CCCCC1
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.28g/mol
Monoisotopic Mass:
259.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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