chlorobenzene;phenol

C12H11ClO — CID 19771485

IUPACchlorobenzene;phenol
SMILESClc1ccccc1.Oc1ccccc1
InChIInChI=1S/C6H5Cl.C6H6O/c2*7-6-4-2-1-3-5-6/h1-5H;1-5,7H
InChIKeyOOOYJJANGWVIRW-UHFFFAOYSA-N
MW206.67 g/mol
LogP3.73
Rot. Bonds

About chlorobenzene;phenol

chlorobenzene;phenol (PubChem CID 19771485) has the molecular formula C12H11ClO and a molecular weight of 206.67 g/mol. Its IUPAC name is chlorobenzene;phenol.

Molecular Properties

Compound Namechlorobenzene;phenol
PubChem CID19771485
Molecular FormulaC12H11ClO
Molecular Weight206.67 g/mol
Exact Mass206.05
IUPAC Namechlorobenzene;phenol
SMILESClc1ccccc1.Oc1ccccc1
InChIInChI=1S/C6H5Cl.C6H6O/c2*7-6-4-2-1-3-5-6/h1-5H;1-5,7H
InChIKeyOOOYJJANGWVIRW-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.67
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

benzene;hypochlorous acid;phenol
CID 174898371
benzene;chlorobenzene
CID 159657667
chlorobenzene;methanol
CID 20549646
azane;hypochlorous acid;phenol
CID 159093398
CID 159904044
CID 159904044
aluminum phenol
CID 19023057
CID 67496590
CID 67496590
argon;phenol
CID 159678450
molybdenum;phenol
CID 154246724
phenol;phosphane
CID 159689182
phenol;tantalum
CID 19915613
chlorobenzene;chromium
CID 139244081

Frequently Asked Questions

What is the IUPAC name of chlorobenzene;phenol?
The IUPAC name of chlorobenzene;phenol (CID 19771485) is chlorobenzene;phenol.
What is the SMILES notation for chlorobenzene;phenol?
The canonical SMILES for chlorobenzene;phenol is Clc1ccccc1.Oc1ccccc1.
What is the InChIKey of chlorobenzene;phenol?
The InChIKey is OOOYJJANGWVIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl.C6H6O/c2*7-6-4-2-1-3-5-6/h1-5H;1-5,7H.
What are the key properties of chlorobenzene;phenol?
chlorobenzene;phenol has a molecular weight of 206.67 g/mol, XLogP of 3.73, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chlorobenzene;phenol is sourced from PubChem (CID 19771485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).