9-Chloro-6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indole

5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene

CAS: 3889-01-8

Molecular Formula	`C12H13ClN2`
Molecular Weight	220.7 g/mol
LogP	2.5
Topological Polar Surface Area	27.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	1
Rotatable Bonds	0
Exact Mass	220.07672
Heavy Atoms	15
Complexity	246.0

Chemical Identifiers

CAS Number	3889-01-8
SMILES	`CC1C2=C3C(=CNC3=C(C=C2)Cl)CCN1`
InChIKey	`OERWUSKCIJQIES-UHFFFAOYSA-N`

📖 Product Overview

9-Chloro-6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indole (CAS: 3889-01-8) is a chemical compound with molecular formula C12H13ClN2 and molecular weight 220.7 g/mol. Its IUPAC systematic name is 5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene. LogP 2.5 Topological Polar Surface Area 27.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 1 Rotatable Bonds 0 Exact Mass 220.07672 Heavy Atoms 15 Complexity 246.0 InChI Key: OERWUSKCIJQIES-UHFFFAOYSA-N. SMILES: CC1C2=C3C(=CNC3=C(C=C2)Cl)CCN1.

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