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3-[(benzyloxy)methyl]benzoic acid

3-[(benzyloxy)methyl]benzoic acid

CAS: 1016891-82-9

Formula: C15H14O3

SMILES: OC(=O)C1=CC=CC(COCC2=CC=CC=C2)=C1

IUPAC: 3-[(benzyloxy)methyl]benzoic acid

InChI: InChI=1S/C15H14O3/c16-15(17)14-8-4-7-13(9-14)11-18-10-12-5-2-1-3-6-12/h1-9H,10-11H2,(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 GDVISPZSSSTPGL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.49
Topological Polar Surface Area 46.53
Polarizability 26.61
Ring Count 2
Rotatable Bond Count 5

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97% <7 Days 1016891-82-9 $144.00-$325.44$144.00$219.84$325.44
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