[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol

C13H9Cl3O2 — CID 114067624

IUPAC[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol
SMILESOCc1cccc(Cl)c1Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H9Cl3O2/c14-9-4-10(15)6-11(5-9)18-13-8(7-17)2-1-3-12(13)16/h1-6,17H,7H2
InChIKeyWWIGAUGMJHPVMU-UHFFFAOYSA-N
MW303.57 g/mol
LogP4.93
Rot. Bonds3

About [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol

[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol (PubChem CID 114067624) has the molecular formula C13H9Cl3O2 and a molecular weight of 303.57 g/mol. Its IUPAC name is [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol
PubChem CID114067624
Molecular FormulaC13H9Cl3O2
Molecular Weight303.57 g/mol
Exact Mass301.97
IUPAC Name[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol
SMILESOCc1cccc(Cl)c1Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H9Cl3O2/c14-9-4-10(15)6-11(5-9)18-13-8(7-17)2-1-3-12(13)16/h1-6,17H,7H2
InChIKeyWWIGAUGMJHPVMU-UHFFFAOYSA-N
XLogP4.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.57
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[2-chloro-6-(hydroxymethyl)phenoxy]phenyl]methanol
CID 114067626
[3-chloro-2-(4-fluorophenoxy)phenyl]methanol
CID 114067610
(3-chloro-2-methoxyphenyl)methanol
CID 54184130
[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol
CID 114069405
[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046982
[3-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 112612722
[3-chloro-2-[(3,5-dimethylphenyl)methoxy]phenyl]methanol
CID 112612639
[3-chloro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
CID 115956314
[1-(3,5-dichlorophenoxy)isoquinolin-3-yl]methanol
CID 61256323
(3-chloro-2-octoxyphenyl)methanol
CID 112612718
[4-(3,5-dichlorophenoxy)-3-pyridinyl]methanol
CID 81237951
[5-(2-chloro-6-fluorophenoxy)-2-ethylphenyl]methanol;ethane
CID 178142129

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol?
The IUPAC name of [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol (CID 114067624) is [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol.
What is the SMILES notation for [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol?
The canonical SMILES for [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol is OCc1cccc(Cl)c1Oc1cc(Cl)cc(Cl)c1.
What is the InChIKey of [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol?
The InChIKey is WWIGAUGMJHPVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl3O2/c14-9-4-10(15)6-11(5-9)18-13-8(7-17)2-1-3-12(13)16/h1-6,17H,7H2.
What are the key properties of [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol?
[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol has a molecular weight of 303.57 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol is sourced from PubChem (CID 114067624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).