(2-chloro-3-phenoxyphenyl)methanol

C13H11ClO2 — CID 157201139

IUPAC(2-chloro-3-phenoxyphenyl)methanol
SMILESOCc1cccc(Oc2ccccc2)c1Cl
InChIInChI=1S/C13H11ClO2/c14-13-10(9-15)5-4-8-12(13)16-11-6-2-1-3-7-11/h1-8,15H,9H2
InChIKeyAQUSWFGJQONHOP-UHFFFAOYSA-N
MW234.68 g/mol
LogP3.62
Rot. Bonds3

About (2-chloro-3-phenoxyphenyl)methanol

(2-chloro-3-phenoxyphenyl)methanol (PubChem CID 157201139) has the molecular formula C13H11ClO2 and a molecular weight of 234.68 g/mol. Its IUPAC name is (2-chloro-3-phenoxyphenyl)methanol.

Molecular Properties

Compound Name(2-chloro-3-phenoxyphenyl)methanol
PubChem CID157201139
Molecular FormulaC13H11ClO2
Molecular Weight234.68 g/mol
Exact Mass234.04
IUPAC Name(2-chloro-3-phenoxyphenyl)methanol
SMILESOCc1cccc(Oc2ccccc2)c1Cl
InChIInChI=1S/C13H11ClO2/c14-13-10(9-15)5-4-8-12(13)16-11-6-2-1-3-7-11/h1-8,15H,9H2
InChIKeyAQUSWFGJQONHOP-UHFFFAOYSA-N
XLogP3.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.68
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-phenoxyphenyl)methanol?
The IUPAC name of (2-chloro-3-phenoxyphenyl)methanol (CID 157201139) is (2-chloro-3-phenoxyphenyl)methanol.
What is the SMILES notation for (2-chloro-3-phenoxyphenyl)methanol?
The canonical SMILES for (2-chloro-3-phenoxyphenyl)methanol is OCc1cccc(Oc2ccccc2)c1Cl.
What is the InChIKey of (2-chloro-3-phenoxyphenyl)methanol?
The InChIKey is AQUSWFGJQONHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClO2/c14-13-10(9-15)5-4-8-12(13)16-11-6-2-1-3-7-11/h1-8,15H,9H2.
What are the key properties of (2-chloro-3-phenoxyphenyl)methanol?
(2-chloro-3-phenoxyphenyl)methanol has a molecular weight of 234.68 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-3-phenoxyphenyl)methanol is sourced from PubChem (CID 157201139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).