8-bromo-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline-4-carboxylic acid

8-bromo-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline-4-carboxylic acid

Formula: C13H12BrNO2

SMILES: OC(=O)C1NC2=CC=C(Br)C=C2C2C=CCC12

IUPAC: 8-bromo-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline-4-carboxylic acid

InChI: InChI=1/C13H12BrNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(8)12(15-11)13(16)17/h1-2,4-6,8-9,12,15H,3H2,(H,16,17)

Composition: C (53.08%), H (4.11%), Br (27.16%), N (4.76%), O (10.88%)

Molar Mass: 294.148

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	3
Exact Mass	293.005142
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	REGZZMYIDMVSBE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.55
Topological Polar Surface Area	49.33
Polarizability	26
Ring Count	3
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H12BrNO2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00