4-methoxy-3-(2,4,5-trichlorophenoxymethyl)benzaldehyde

4-methoxy-3-(2,4,5-trichlorophenoxymethyl)benzaldehyde

CAS: 832739-71-6

Formula: C15H11Cl3O3

SMILES: COC1=CC=C(C=O)C=C1COC1=CC(Cl)=C(Cl)C=C1Cl

IUPAC: 4-methoxy-3-[(2,4,5-trichlorophenoxy)methyl]benzaldehyde

InChI: InChI=1S/C15H11Cl3O3/c1-20-14-3-2-9(7-19)4-10(14)8-21-15-6-12(17)11(16)5-13(15)18/h2-7H,8H2,1H3

Composition: C (52.13%), H (3.21%), Cl (30.77%), O (13.89%)

Molar Mass: 345.6

Atom Count: 32

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	343.9773773
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ZJPHSBBJXYYGIA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.6
Topological Polar Surface Area	35.53
Polarizability	32.59
Ring Count	2
Rotatable Bond Count	5

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