(3-chlorophenyl)-(2,6-dichlorophenyl)methanol

C13H9Cl3O — CID 63894270

IUPAC(3-chlorophenyl)-(2,6-dichlorophenyl)methanol
SMILESOC(c1cccc(Cl)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C13H9Cl3O/c14-9-4-1-3-8(7-9)13(17)12-10(15)5-2-6-11(12)16/h1-7,13,17H
InChIKeyZFYUFOKIMQGXCU-UHFFFAOYSA-N
MW287.57 g/mol
LogP4.73
Rot. Bonds2

About (3-chlorophenyl)-(2,6-dichlorophenyl)methanol

(3-chlorophenyl)-(2,6-dichlorophenyl)methanol (PubChem CID 63894270) has the molecular formula C13H9Cl3O and a molecular weight of 287.57 g/mol. Its IUPAC name is (3-chlorophenyl)-(2,6-dichlorophenyl)methanol.

Molecular Properties

Compound Name(3-chlorophenyl)-(2,6-dichlorophenyl)methanol
PubChem CID63894270
Molecular FormulaC13H9Cl3O
Molecular Weight287.57 g/mol
Exact Mass285.97
IUPAC Name(3-chlorophenyl)-(2,6-dichlorophenyl)methanol
SMILESOC(c1cccc(Cl)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C13H9Cl3O/c14-9-4-1-3-8(7-9)13(17)12-10(15)5-2-6-11(12)16/h1-7,13,17H
InChIKeyZFYUFOKIMQGXCU-UHFFFAOYSA-N
XLogP4.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.57
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chlorophenyl)methanediol
CID 20679602
(3-chlorophenyl)-(4-iodophenyl)methanol
CID 114982492
(3-chlorophenyl)-(3,5-difluorophenyl)methanol
CID 2757448
(3-chlorophenyl)-(3-phenylphenyl)methanol
CID 171366588
(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol
CID 63896004
(3-chlorophenyl)-fluoromethanol
CID 70239224
(2R)-2-(3-chlorophenyl)-2-hydroxyacetaldehyde
CID 140582980
(S)-(3-chloro-5-fluorophenyl)-(3-chlorophenyl)methanol
CID 7153369
(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol
CID 93312224
[4-(aminomethyl)phenyl]-(3-chlorophenyl)methanol
CID 82026496
(R)-(2-amino-5-chlorophenyl)-(2,6-dichlorophenyl)methanol
CID 129389406
(S)-(2-amino-5-chlorophenyl)-(2,6-dichlorophenyl)methanol
CID 129389407

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-(2,6-dichlorophenyl)methanol?
The IUPAC name of (3-chlorophenyl)-(2,6-dichlorophenyl)methanol (CID 63894270) is (3-chlorophenyl)-(2,6-dichlorophenyl)methanol.
What is the SMILES notation for (3-chlorophenyl)-(2,6-dichlorophenyl)methanol?
The canonical SMILES for (3-chlorophenyl)-(2,6-dichlorophenyl)methanol is OC(c1cccc(Cl)c1)c1c(Cl)cccc1Cl.
What is the InChIKey of (3-chlorophenyl)-(2,6-dichlorophenyl)methanol?
The InChIKey is ZFYUFOKIMQGXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl3O/c14-9-4-1-3-8(7-9)13(17)12-10(15)5-2-6-11(12)16/h1-7,13,17H.
What are the key properties of (3-chlorophenyl)-(2,6-dichlorophenyl)methanol?
(3-chlorophenyl)-(2,6-dichlorophenyl)methanol has a molecular weight of 287.57 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-(2,6-dichlorophenyl)methanol is sourced from PubChem (CID 63894270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).