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6-bromo-4,4-dimethyl-2,3-dihydro-1H-quinoline hydrochloride

6-bromo-4,4-dimethyl-2,3-dihydro-1H-quinoline hydrochloride

CAS: 1187830-63-2

Formula: C11H15BrClN

SMILES: Cl[H].CC1(C)CCNC2=C1C=C(Br)C=C2

IUPAC: 6-bromo-4,4-dimethyl-1,2,3,4-tetrahydroquinoline hydrochloride

InChI: InChI=1S/C11H14BrN.ClH/c1-11(2)5-6-13-10-4-3-8(12)7-9(10)11;/h3-4,7,13H,5-6H2,1-2H3;1H

Composition: C (47.77%), H (5.47%), Br (28.89%), Cl (12.82%), N (5.06%)

Molar Mass: 276.6

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 275.00764
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey LVPXLOLJEQJSLT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.81
Topological Polar Surface Area 12.03
Polarizability 22.58
Ring Count 2
Rotatable Bond Count 0

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