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4-[(3,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

4-[(3,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

CAS: 938277-75-9

Formula: C15H12Cl2O4

SMILES: COC1=C(OCC2=CC(Cl)=C(Cl)C=C2)C=CC(=C1)C(O)=O

IUPAC: 4-[(3,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

InChI: InChI=1S/C15H12Cl2O4/c1-20-14-7-10(15(18)19)3-5-13(14)21-8-9-2-4-11(16)12(17)6-9/h2-7H,8H2,1H3,(H,18,19)

Composition: C (55.07%), H (3.70%), Cl (21.67%), O (19.56%)

Molar Mass: 327.16

Atom Count: 33

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 326.0112643
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey GGXSVUIRHBNBFW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.46
Topological Polar Surface Area 55.76
Polarizability 31.13
Ring Count 2
Rotatable Bond Count 5

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95% <2 Days 938277-75-9 $154.01-$593.57$154.01$179.68$593.57
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