1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene

C14H12Cl2O2 — CID 800758

IUPAC1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene
SMILESCOc1cc(-c2ccc(Cl)c(OC)c2)ccc1Cl
InChIInChI=1S/C14H12Cl2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,1-2H3
InChIKeyGHTWWNRAWZNEDQ-UHFFFAOYSA-N
MW283.15 g/mol
LogP4.68
Rot. Bonds3

About 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene

1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene (PubChem CID 800758) has the molecular formula C14H12Cl2O2 and a molecular weight of 283.15 g/mol. Its IUPAC name is 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene.

Molecular Properties

Compound Name1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene
PubChem CID800758
Molecular FormulaC14H12Cl2O2
Molecular Weight283.15 g/mol
Exact Mass282.02
IUPAC Name1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene
SMILESCOc1cc(-c2ccc(Cl)c(OC)c2)ccc1Cl
InChIInChI=1S/C14H12Cl2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,1-2H3
InChIKeyGHTWWNRAWZNEDQ-UHFFFAOYSA-N
XLogP4.68
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.15
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dichloro-5-(4-chloro-3-methoxyphenyl)benzene
CID 118811160
1,2,5-trichloro-3-(4-chloro-3-methoxyphenyl)benzene
CID 134627061
3-(4-chloro-3-methoxyphenyl)cyclohept-2-en-1-one
CID 107382719
4-(4-chloro-3-methoxyphenyl)-1,2,3,6-tetrahydropyridine
CID 79712172
4-(4-chloro-3-methoxyphenyl)-3-fluoroaniline
CID 79711769
[3-chloro-4-(4-chloro-3-methoxyphenyl)phenyl]methanamine
CID 114076769
2-chloro-5-(3-chloro-4-methoxyphenyl)aniline
CID 62908744
1,5-dichloro-2-(3,4-dichlorophenyl)-4-methoxybenzene
CID 10381430
1-[2-(4-chloro-3-methoxyphenyl)phenyl]ethanone
CID 79711690
4-(4-chloro-3-methoxyphenyl)-1H-pyrimidin-6-one
CID 136769438
1-[5-(4-chloro-3-methoxyphenyl)furan-2-yl]ethanone
CID 107622692
4-chloro-6-(4-chloro-3-methoxyphenyl)-2-ethylpyrimidine
CID 80935506

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene?
The IUPAC name of 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene (CID 800758) is 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene.
What is the SMILES notation for 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene?
The canonical SMILES for 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene is COc1cc(-c2ccc(Cl)c(OC)c2)ccc1Cl.
What is the InChIKey of 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene?
The InChIKey is GHTWWNRAWZNEDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,1-2H3.
What are the key properties of 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene?
1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene has a molecular weight of 283.15 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-(4-chloro-3-methoxyphenyl)-2-methoxybenzene is sourced from PubChem (CID 800758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).