1-(5-chloro-1H-indol-3-yl)propan-2-one

1-(5-chloro-1H-indol-3-yl)propan-2-one

CAS: 50526-25-5

Formula: C11H10ClNO

SMILES: CC(=O)CC1=CNC2=CC=C(Cl)C=C12

IUPAC: 1-(5-chloro-1H-indol-3-yl)propan-2-one

InChI: InChI=1S/C11H10ClNO/c1-7(14)4-8-6-13-11-3-2-9(12)5-10(8)11/h2-3,5-6,13H,4H2,1H3

Composition: C (63.62%), H (4.85%), Cl (17.07%), N (6.75%), O (7.70%)

Molar Mass: 207.66

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	207.0450916
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	NKIIAHUNWNEGHJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.81
Topological Polar Surface Area	32.86
Polarizability	22.99
Ring Count	2
Rotatable Bond Count	2

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