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

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

CAS: 938247-60-0

Formula: C16H16O4

SMILES: COC1=CC=CC(C(O)=O)=C1OCC1=C(C)C=CC=C1

IUPAC: 3-methoxy-2-[(2-methylphenyl)methoxy]benzoic acid

InChI: InChI=1S/C16H16O4/c1-11-6-3-4-7-12(11)10-20-15-13(16(17)18)8-5-9-14(15)19-2/h3-9H,10H2,1-2H3,(H,17,18)

Composition: C (70.58%), H (5.92%), O (23.50%)

Molar Mass: 272.3

Atom Count: 36

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 272.104858995
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey AOHFBOMPMUJIAW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.89
Topological Polar Surface Area 55.76
Polarizability 29.05
Ring Count 2
Rotatable Bond Count 5

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95% <2 Days 938247-60-0 $134.76$134.76
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