5-bromo-2-[(2-chlorophenyl)methoxy]benzoic acid

5-bromo-2-[(2-chlorophenyl)methoxy]benzoic acid

CAS: 62176-33-4

Formula: C14H10BrClO3

SMILES: OC(=O)C1=C(OCC2=C(Cl)C=CC=C2)C=CC(Br)=C1

IUPAC: 5-bromo-2-[(2-chlorophenyl)methoxy]benzoic acid

InChI: InChI=1S/C14H10BrClO3/c15-10-5-6-13(11(7-10)14(17)18)19-8-9-3-1-2-4-12(9)16/h1-7H,8H2,(H,17,18)

Composition: C (49.23%), H (2.95%), Br (23.39%), Cl (10.38%), O (14.05%)

Molar Mass: 341.59

Atom Count: 29

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	339.950185
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PXGMUUNXLCEOBW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.82
Topological Polar Surface Area	46.53
Polarizability	29.51
Ring Count	2
Rotatable Bond Count	4

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	62176-33-4		$134.76$134.76