1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene

C14H12Cl2O3 — CID 173291827

IUPAC1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
SMILESCOc1cccc(OC)c1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C14H12Cl2O3/c1-17-11-7-4-8-12(18-2)14(11)19-10-6-3-5-9(15)13(10)16/h3-8H,1-2H3
InChIKeyZNFDVJDVIJTOOD-UHFFFAOYSA-N
MW299.15 g/mol
LogP4.80
Rot. Bonds4

About 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene

1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene (PubChem CID 173291827) has the molecular formula C14H12Cl2O3 and a molecular weight of 299.15 g/mol. Its IUPAC name is 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene.

Molecular Properties

Compound Name1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
PubChem CID173291827
Molecular FormulaC14H12Cl2O3
Molecular Weight299.15 g/mol
Exact Mass298.02
IUPAC Name1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
SMILESCOc1cccc(OC)c1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C14H12Cl2O3/c1-17-11-7-4-8-12(18-2)14(11)19-10-6-3-5-9(15)13(10)16/h3-8H,1-2H3
InChIKeyZNFDVJDVIJTOOD-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

1,2-dichloro-3-(2,6-dichlorophenoxy)benzene
CID 72941859
2-chloro-6-(2,6-dimethoxyphenoxy)benzenecarbothioamide
CID 62495368
CID 57455647
CID 57455647
2-chloro-6-(2,6-dimethoxyphenoxy)benzenecarboximidamide
CID 62496011
1-chloro-2-methoxybenzene
CID 13011
1,3-dichloro-2-(2,3-dimethoxyphenyl)benzene
CID 16755069
4-(2,3-dichlorophenoxy)-6-methoxy-1,3,5-triazin-2-amine
CID 80881232
(2-chloro-6-methoxyphenoxy)boronic acid
CID 142775747
3,4,6-trichloro-5-(2,6-dimethoxyphenoxy)benzene-1,2-dicarbonitrile
CID 122656820
2-chloro-6-methoxybenzenethiol
CID 91874124
1,2-dichloro-3-[(2-methylpropan-2-yl)oxy]benzene
CID 162775400
2,3-dichloro-N-(2-methoxyphenyl)aniline
CID 82537063

Frequently Asked Questions

What is the IUPAC name of 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene?
The IUPAC name of 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene (CID 173291827) is 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene.
What is the SMILES notation for 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene?
The canonical SMILES for 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene is COc1cccc(OC)c1Oc1cccc(Cl)c1Cl.
What is the InChIKey of 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene?
The InChIKey is ZNFDVJDVIJTOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O3/c1-17-11-7-4-8-12(18-2)14(11)19-10-6-3-5-9(15)13(10)16/h3-8H,1-2H3.
What are the key properties of 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene?
1,2-dichloro-3-(2,6-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 1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene is sourced from PubChem (CID 173291827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).