RefChem:117091

2-[4-(6-bromo-1-methylbenzo[cd]indol-1-ium-2-yl)-N-ethylanilino]ethanol acetate

Also Known As: 6-Bromo-2-(4-(ethyl(2-hydroxyethyl)amino)phenyl)-1-methylbenz(cd)indolium acetate|Benz(cd)indolium, 6-bromo-2-(4-(ethyl(2-hydroxyethyl)amino)phenyl)-1-methyl-, acetate (1:1)|6-Bromo-2-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-1-methylbenz[cd]indolium acetate|Benz[cd]indolium, 6-bromo-2-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-1-methyl-, acetate (salt)|2-[4-(6-bromo-1-methylbenzo[cd]indol-1-ium-2-yl)-N-ethylanilino]ethanol,acetate|6-Bromo-2-{4-[ethyl(2-hydroxyethyl)amino]phenyl}-1-methylbenzo[cd]indol-1-ium acetate|280-355-8|Benz(cd)indolium, 6-bromo-2-(4-(ethyl(2-hydroxyethyl)amino)phenyl)-1-methyl-, acetate (salt)|Benz[cd]indolium, 6-bromo-2-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-1-methyl-, acetate (1:1)

Molecular Formula	C24H25BrN2O3
Molecular Weight	468.10486 g/mol
LogP	3.3019
Topological Polar Surface Area	66.6 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	468.10486
Monoisotopic Mass	468.10486
Heavy Atoms	30
Complexity	554.0

Chemical Identifiers

CAS Number	83270-34-2
SMILES	CCN(CCO)C1=CC=C(C=C1)C2=[N+](C3=C4C2=CC=CC4=C(C=C3)Br)C.CC(=O)[O-]
InChIKey	BWOJXALPWMASQP-UHFFFAOYSA-M