7-bromo-1,2,3,4-tetrahydroquinoline hydrochloride

7-bromo-1,2,3,4-tetrahydroquinoline hydrochloride

CAS: 1195901-53-1

Formula: C9H11BrClN

SMILES: Cl.BrC1=CC=C2CCCNC2=C1

IUPAC: 7-bromo-1,2,3,4-tetrahydroquinoline hydrochloride

InChI: InChI=1S/C9H10BrN.ClH/c10-8-4-3-7-2-1-5-11-9(7)6-8;/h3-4,6,11H,1-2,5H2;1H

Composition: C (43.49%), H (4.46%), Br (32.15%), Cl (14.26%), N (5.64%)

Molar Mass: 248.55

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	246.97634
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KPGKNWBIPSLETQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.79
Topological Polar Surface Area	12.03
Polarizability	18.94
Ring Count	2
Rotatable Bond Count	0

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