2-[(4-methylphenyl)methoxy]benzoic acid

2-[(4-methylphenyl)methoxy]benzoic acid

CAS: 52803-45-9

Formula: C15H14O3

SMILES: CC1=CC=C(COC2=C(C=CC=C2)C(O)=O)C=C1

IUPAC: 2-[(4-methylphenyl)methoxy]benzoic acid

InChI: InChI=1S/C15H14O3/c1-11-6-8-12(9-7-11)10-18-14-5-3-2-4-13(14)15(16)17/h2-9H,10H2,1H3,(H,16,17)

Composition: C (74.36%), H (5.82%), O (19.81%)

Molar Mass: 242.274

Atom Count: 32

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	242.094294311
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ROMNRINEOJSXGP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.43
Topological Polar Surface Area	46.53
Polarizability	26.52
Ring Count	2
Rotatable Bond Count	4

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