2-[(2,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

2-[(2,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

CAS: 872197-30-3

Formula: C15H12Cl2O4

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

IUPAC: 2-[(2,4-dichlorophenyl)methoxy]-3-methoxybenzoic acid

InChI: InChI=1S/C15H12Cl2O4/c1-20-13-4-2-3-11(15(18)19)14(13)21-8-9-5-6-10(16)7-12(9)17/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	JLKDMNKYHBKWCV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.46
Topological Polar Surface Area	55.76
Polarizability	31.11
Ring Count	2
Rotatable Bond Count	5

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