1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene

C14H12Cl2O — CID 71651492

IUPAC1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene
SMILESCc1ccc(COc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C14H12Cl2O/c1-10-2-4-11(5-3-10)9-17-14-8-12(15)6-7-13(14)16/h2-8H,9H2,1H3
InChIKeyITSHAYFUMNXPEU-UHFFFAOYSA-N
MW267.16 g/mol
LogP4.88
Rot. Bonds3

About 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene

1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene (PubChem CID 71651492) has the molecular formula C14H12Cl2O and a molecular weight of 267.16 g/mol. Its IUPAC name is 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene.

Molecular Properties

Compound Name1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene
PubChem CID71651492
Molecular FormulaC14H12Cl2O
Molecular Weight267.16 g/mol
Exact Mass266.03
IUPAC Name1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene
SMILESCc1ccc(COc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C14H12Cl2O/c1-10-2-4-11(5-3-10)9-17-14-8-12(15)6-7-13(14)16/h2-8H,9H2,1H3
InChIKeyITSHAYFUMNXPEU-UHFFFAOYSA-N
XLogP4.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.16
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-dichloro-2-[(3,5-dimethylphenyl)methoxy]benzene
CID 78906184
[4-[(2,5-dichlorophenoxy)methyl]phenyl]methanamine
CID 22688669
5-chloro-2-[(4-methylphenyl)methoxy]aniline
CID 19624539
1-[4-[(2-chloro-5-methylphenoxy)methyl]phenyl]-N-methylmethanamine
CID 62485881
2-[4-[(2,5-dichlorophenoxy)methyl]phenyl]acetic acid
CID 22684497
4-chloro-2-[(4-methylphenyl)methoxy]benzenecarbothioamide
CID 114323054
5-chloro-2-[(4-methylphenyl)methoxy]benzaldehyde
CID 892242
2-chloro-4-(chloromethyl)-1-[(4-methylphenyl)methoxy]benzene
CID 63535207
2-chloro-5-[(2-chloro-5-methylphenoxy)methyl]pyridine
CID 43245470
2-[4-[(2,5-dichlorophenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylate
CID 7745333
2-(2,5-dichlorophenoxy)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 112774399
1-chloro-3-[(4-methylphenyl)methoxy]benzene
CID 60627875

Frequently Asked Questions

What is the IUPAC name of 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene?
The IUPAC name of 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene (CID 71651492) is 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene.
What is the SMILES notation for 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene?
The canonical SMILES for 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene is Cc1ccc(COc2cc(Cl)ccc2Cl)cc1.
What is the InChIKey of 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene?
The InChIKey is ITSHAYFUMNXPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O/c1-10-2-4-11(5-3-10)9-17-14-8-12(15)6-7-13(14)16/h2-8H,9H2,1H3.
What are the key properties of 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene?
1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene has a molecular weight of 267.16 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dichloro-2-[(4-methylphenyl)methoxy]benzene is sourced from PubChem (CID 71651492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).