bis(4-chlorophenyl)methanol

C13H10Cl2O — CID 7033

IUPACbis(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13,16H
InChIKeyPHUYGURFBULKPA-UHFFFAOYSA-N
MW253.13 g/mol
LogP4.08
Rot. Bonds2

About bis(4-chlorophenyl)methanol

bis(4-chlorophenyl)methanol (PubChem CID 7033) has the molecular formula C13H10Cl2O and a molecular weight of 253.13 g/mol. Its IUPAC name is bis(4-chlorophenyl)methanol.

Molecular Properties

Compound Namebis(4-chlorophenyl)methanol
PubChem CID7033
Molecular FormulaC13H10Cl2O
Molecular Weight253.13 g/mol
Exact Mass252.01
IUPAC Namebis(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13,16H
InChIKeyPHUYGURFBULKPA-UHFFFAOYSA-N
XLogP4.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.13
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Dicofol
CID 8268
1,1-Bis(4-chlorophenyl)ethanol
CID 6624
2,4-Dichlorobenzyl alcohol
CID 15684
Benzhydrol
CID 7037
4-Chloro-beta-(4-chlorophenyl)benzeneethanol
CID 17533
Phenaglycodol
CID 6617
Tris(4-chlorophenyl)methanol
CID 76379
4-Chlorobenzyl alcohol
CID 13397
Fenpentadiol
CID 85896
2,2,2-Trichloro-1-phenylethanol
CID 16150
4-Chlorobenzhydrol
CID 8401
Benzenemethanol, 4-chloro-alpha-methyl-
CID 18825

Frequently Asked Questions

What is the IUPAC name of bis(4-chlorophenyl)methanol?
The IUPAC name of bis(4-chlorophenyl)methanol (CID 7033) is bis(4-chlorophenyl)methanol.
What is the SMILES notation for bis(4-chlorophenyl)methanol?
The canonical SMILES for bis(4-chlorophenyl)methanol is OC(c1ccc(Cl)cc1)c1ccc(Cl)cc1.
What is the InChIKey of bis(4-chlorophenyl)methanol?
The InChIKey is PHUYGURFBULKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13,16H.
What are the key properties of bis(4-chlorophenyl)methanol?
bis(4-chlorophenyl)methanol has a molecular weight of 253.13 g/mol, XLogP of 4.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-chlorophenyl)methanol is sourced from PubChem (CID 7033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).