2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene

C14H12Cl2O3 — CID 102485149

IUPAC2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene
SMILESCOc1cc(OC)cc(Oc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H12Cl2O3/c1-17-10-6-11(18-2)8-12(7-10)19-14-4-3-9(15)5-13(14)16/h3-8H,1-2H3
InChIKeyYQUPHJNAXAIQCF-UHFFFAOYSA-N
MW299.15 g/mol
LogP4.80
Rot. Bonds4

About 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene

2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene (PubChem CID 102485149) has the molecular formula C14H12Cl2O3 and a molecular weight of 299.15 g/mol. Its IUPAC name is 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene.

Molecular Properties

Compound Name2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene
PubChem CID102485149
Molecular FormulaC14H12Cl2O3
Molecular Weight299.15 g/mol
Exact Mass298.02
IUPAC Name2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene
SMILESCOc1cc(OC)cc(Oc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H12Cl2O3/c1-17-10-6-11(18-2)8-12(7-10)19-14-4-3-9(15)5-13(14)16/h3-8H,1-2H3
InChIKeyYQUPHJNAXAIQCF-UHFFFAOYSA-N
XLogP4.80
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.15
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-amino-2-chlorophenoxy)-5-methoxybenzonitrile
CID 103566323
3-(2,4-dichlorophenoxy)-5-propoxyaniline
CID 80748821
methyl 4-(2,4-dichlorophenoxy)benzoate
CID 28911715
2-chloro-4-(2,4-dichlorophenoxy)benzonitrile
CID 21429570
2,4-dichloro-1-[3-(4-methoxyphenoxy)propoxy]benzene
CID 2252113
2,4-dichloro-1-(trideuteriomethoxy)benzene
CID 141358841
4-chloro-2-(3,5-dimethoxyphenoxy)benzenecarboximidamide
CID 63094563
2-(2,4-dichlorophenoxy)-4-methoxybenzenecarboximidamide
CID 81302946
methyl 5-(2,4-dichlorophenoxy)-2-methylbenzoate
CID 20648456
1-[3-(2,4-dichlorophenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 106531214
2-[4-(2,4-dichlorophenoxy)phenyl]furan
CID 168526554
[4-(2,4-dichlorophenoxy)phenyl] propanoate
CID 67553768

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene?
The IUPAC name of 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene (CID 102485149) is 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene.
What is the SMILES notation for 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene?
The canonical SMILES for 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene is COc1cc(OC)cc(Oc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene?
The InChIKey is YQUPHJNAXAIQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O3/c1-17-10-6-11(18-2)8-12(7-10)19-14-4-3-9(15)5-13(14)16/h3-8H,1-2H3.
What are the key properties of 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene?
2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene has a molecular weight of 299.15 g/mol, XLogP of 4.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-1-(3,5-dimethoxyphenoxy)benzene is sourced from PubChem (CID 102485149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).