[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol

C15H13Cl3O3 — CID 104665993

IUPAC[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol
SMILESCOc1cc(Cl)cc(CO)c1OCc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H13Cl3O3/c1-20-14-6-12(17)4-9(7-19)15(14)21-8-10-5-11(16)2-3-13(10)18/h2-6,19H,7-8H2,1H3
InChIKeyMHPFZSLLLQGMOX-UHFFFAOYSA-N
MW347.63 g/mol
LogP4.73
Rot. Bonds5

About [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol

[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol (PubChem CID 104665993) has the molecular formula C15H13Cl3O3 and a molecular weight of 347.63 g/mol. Its IUPAC name is [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol
PubChem CID104665993
Molecular FormulaC15H13Cl3O3
Molecular Weight347.63 g/mol
Exact Mass345.99
IUPAC Name[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol
SMILESCOc1cc(Cl)cc(CO)c1OCc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H13Cl3O3/c1-20-14-6-12(17)4-9(7-19)15(14)21-8-10-5-11(16)2-3-13(10)18/h2-6,19H,7-8H2,1H3
InChIKeyMHPFZSLLLQGMOX-UHFFFAOYSA-N
XLogP4.73
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.63
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3,5-dichloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanol
CID 43646746
2-[4-chloro-2-(hydroxymethyl)-6-methoxyphenoxy]ethanol
CID 104666066
[5-chloro-3-methoxy-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
CID 104666095
(5-chloro-3-methoxy-2-pentoxyphenyl)methanol
CID 113438830
(5-chloro-3-methoxy-2-prop-2-ynoxyphenyl)methanol
CID 104666169
[5-chloro-2-(2-ethylsulfonylethoxy)-3-methoxyphenyl]methanol
CID 104666078
[3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046936
[5-chloro-2-(3,3-dimethylbutoxy)-3-methoxyphenyl]methanol
CID 113438836
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937
(2-but-3-ynoxy-5-chloro-3-methoxyphenyl)methanol
CID 104665943
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-fluoro-3-(hydroxymethyl)phenyl]methanol
CID 99823533
5-chloro-1-(chloromethyl)-2-[(2,3-dichlorophenyl)methoxy]-3-methoxybenzene
CID 107306943

Frequently Asked Questions

What is the IUPAC name of [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol?
The IUPAC name of [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol (CID 104665993) is [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol.
What is the SMILES notation for [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol?
The canonical SMILES for [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol is COc1cc(Cl)cc(CO)c1OCc1cc(Cl)ccc1Cl.
What is the InChIKey of [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol?
The InChIKey is MHPFZSLLLQGMOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl3O3/c1-20-14-6-12(17)4-9(7-19)15(14)21-8-10-5-11(16)2-3-13(10)18/h2-6,19H,7-8H2,1H3.
What are the key properties of [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol?
[5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol has a molecular weight of 347.63 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-2-[(2,5-dichlorophenyl)methoxy]-3-methoxyphenyl]methanol is sourced from PubChem (CID 104665993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).