1-chloro-3-(2-iodophenoxy)benzene

C12H8ClIO — CID 138106392

IUPAC1-chloro-3-(2-iodophenoxy)benzene
SMILESClc1cccc(Oc2ccccc2I)c1
InChIInChI=1S/C12H8ClIO/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h1-8H
InChIKeyOBMHKNRWCRDWJS-UHFFFAOYSA-N
MW330.55 g/mol
LogP4.74
Rot. Bonds2

About 1-chloro-3-(2-iodophenoxy)benzene

1-chloro-3-(2-iodophenoxy)benzene (PubChem CID 138106392) has the molecular formula C12H8ClIO and a molecular weight of 330.55 g/mol. Its IUPAC name is 1-chloro-3-(2-iodophenoxy)benzene.

Molecular Properties

Compound Name1-chloro-3-(2-iodophenoxy)benzene
PubChem CID138106392
Molecular FormulaC12H8ClIO
Molecular Weight330.55 g/mol
Exact Mass329.93
IUPAC Name1-chloro-3-(2-iodophenoxy)benzene
SMILESClc1cccc(Oc2ccccc2I)c1
InChIInChI=1S/C12H8ClIO/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h1-8H
InChIKeyOBMHKNRWCRDWJS-UHFFFAOYSA-N
XLogP4.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.55
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1,2-dichloro-3-(3-chlorophenoxy)benzene
CID 72941852
1,2,4-trichloro-5-(3-chlorophenoxy)benzene
CID 23274709
4-chloro-2-(2-iodophenoxy)aniline
CID 115469275
2-[3-(2-iodophenoxy)phenyl]ethanamine
CID 63941765
2-(3-chlorophenoxy)benzoyl bromide
CID 139662791
1,2,3-trichloro-4-(3-chlorophenoxy)benzene
CID 23274712
2-(3-chlorophenoxy)-4-fluoroaniline
CID 62378026
7-(3-chlorophenoxy)-1-benzofuran
CID 175270719
1-chloro-2-(3-chlorophenoxy)-4-methylbenzene
CID 170985153
2-(3-chlorophenoxy)-6-fluorobenzonitrile
CID 24777412
5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine
CID 79727918
1-iodo-2-(4-methoxyphenoxy)benzene
CID 11347944

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(2-iodophenoxy)benzene?
The IUPAC name of 1-chloro-3-(2-iodophenoxy)benzene (CID 138106392) is 1-chloro-3-(2-iodophenoxy)benzene.
What is the SMILES notation for 1-chloro-3-(2-iodophenoxy)benzene?
The canonical SMILES for 1-chloro-3-(2-iodophenoxy)benzene is Clc1cccc(Oc2ccccc2I)c1.
What is the InChIKey of 1-chloro-3-(2-iodophenoxy)benzene?
The InChIKey is OBMHKNRWCRDWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClIO/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h1-8H.
What are the key properties of 1-chloro-3-(2-iodophenoxy)benzene?
1-chloro-3-(2-iodophenoxy)benzene has a molecular weight of 330.55 g/mol, XLogP of 4.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(2-iodophenoxy)benzene is sourced from PubChem (CID 138106392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).