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3-(2-chloroethyl)-1H-indole

3-(2-chloroethyl)-1H-indole

CAS: 32933-86-1

Formula: C10H10ClN

SMILES: ClCCC1=CNC2=CC=CC=C12

IUPAC: 3-(2-chloroethyl)-1H-indole

InChI: InChI=1S/C10H10ClN/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6H2

Composition: C (66.86%), H (5.61%), Cl (19.73%), N (7.80%)

Molar Mass: 179.65

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 179.050177
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 1
InChIKey JRASUUTVFCLPPO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.77
Topological Polar Surface Area 15.79
Polarizability 20.97
Ring Count 2
Rotatable Bond Count 2

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