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2-(3-methylphenoxy)benzoic acid

2-(3-methylphenoxy)benzoic acid

CAS: 1621038

Formula: C14H12O3

SMILES: CC1=CC(OC2=CC=CC=C2C(O)=O)=CC=C1

IUPAC: 2-(3-methylphenoxy)benzoic acid

InChI: InChI=1S/C14H12O3/c1-10-5-4-6-11(9-10)17-13-8-3-2-7-12(13)14(15)16/h2-9H,1H3,(H,15,16)

Composition: C (73.67%), H (5.30%), O (21.03%)

Molar Mass: 228.247

Atom Count: 29

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 228.078644246
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LLNYWMNWRYXWPC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.6
Topological Polar Surface Area 46.53
Polarizability 24.74
Ring Count 2
Rotatable Bond Count 3

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Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 1621038 $103.68-$689.28$103.68$224.64$689.28
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