4-[(4-chlorophenyl)methoxy]-1H-indole-2-carboxylic acid

4-[(4-chlorophenyl)methoxy]-1H-indole-2-carboxylic acid

Formula: C16H12ClNO3

SMILES: OC(=O)C1=CC2=C(OCC3=CC=C(Cl)C=C3)C=CC=C2N1

IUPAC: 4-[(4-chlorophenyl)methoxy]-1H-indole-2-carboxylic acid

InChI: InChI=1S/C16H12ClNO3/c17-11-6-4-10(5-7-11)9-21-15-3-1-2-13-12(15)8-14(18-13)16(19)20/h1-8,18H,9H2,(H,19,20)

Composition: C (63.69%), H (4.01%), Cl (11.75%), N (4.64%), O (15.91%)

Molar Mass: 301.73

Atom Count: 33

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	301.050571
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	XZHGAOIMMHDLOQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.16
Topological Polar Surface Area	62.32
Polarizability	31.83
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H12ClNO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00