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

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

CAS: 24955-86-0

Formula: C11H10ClNO

SMILES: ClCCC(=O)C1=CNC2=CC=CC=C12

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

InChI: InChI=1S/C11H10ClNO/c12-6-5-11(14)9-7-13-10-4-2-1-3-8(9)10/h1-4,7,13H,5-6H2

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	IYKXWMCCLVVKRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57
Topological Polar Surface Area	32.86
Polarizability	22.93
Ring Count	2
Rotatable Bond Count	3

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