3-chloro-4-(2,3-dichlorophenoxy)thiophene

C10H5Cl3OS — CID 173291739

IUPAC3-chloro-4-(2,3-dichlorophenoxy)thiophene
SMILESClc1cscc1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C10H5Cl3OS/c11-6-2-1-3-8(10(6)13)14-9-5-15-4-7(9)12/h1-5H
InChIKeyVWOQUNXOBXLCOY-UHFFFAOYSA-N
MW279.57 g/mol
LogP5.50
Rot. Bonds2

About 3-chloro-4-(2,3-dichlorophenoxy)thiophene

3-chloro-4-(2,3-dichlorophenoxy)thiophene (PubChem CID 173291739) has the molecular formula C10H5Cl3OS and a molecular weight of 279.57 g/mol. Its IUPAC name is 3-chloro-4-(2,3-dichlorophenoxy)thiophene.

Molecular Properties

Compound Name3-chloro-4-(2,3-dichlorophenoxy)thiophene
PubChem CID173291739
Molecular FormulaC10H5Cl3OS
Molecular Weight279.57 g/mol
Exact Mass277.91
IUPAC Name3-chloro-4-(2,3-dichlorophenoxy)thiophene
SMILESClc1cscc1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C10H5Cl3OS/c11-6-2-1-3-8(10(6)13)14-9-5-15-4-7(9)12/h1-5H
InChIKeyVWOQUNXOBXLCOY-UHFFFAOYSA-N
XLogP5.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.57
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dichloro-3-(2,6-dichlorophenoxy)benzene
CID 72941859
3-chloro-4-(2,3-dichlorophenoxy)phenol
CID 154322466
1,2-dichloro-3-(2,5-dichlorophenoxy)benzene
CID 72941858
1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
CID 173291827
2-[2-chloro-6-(2,3-dichlorophenoxy)phenyl]ethanamine
CID 63815236
1-chloro-3-(3-chloro-2-fluorophenoxy)-2-fluorobenzene
CID 141078897
1,2-dichloro-3-(3-chlorophenoxy)benzene
CID 72941852
1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
CID 43282384
4-chloro-2-(2,3-dichlorophenoxy)benzaldehyde
CID 114844667
1,2-dichloro-3-[(2-methylpropan-2-yl)oxy]benzene
CID 162775400
(1S)-1-[2-(2,3-dichlorophenoxy)-6-fluorophenyl]ethanol
CID 55185227
5-bromo-2-(2,3-dichlorophenoxy)pyrimidine
CID 13336590

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-(2,3-dichlorophenoxy)thiophene?
The IUPAC name of 3-chloro-4-(2,3-dichlorophenoxy)thiophene (CID 173291739) is 3-chloro-4-(2,3-dichlorophenoxy)thiophene.
What is the SMILES notation for 3-chloro-4-(2,3-dichlorophenoxy)thiophene?
The canonical SMILES for 3-chloro-4-(2,3-dichlorophenoxy)thiophene is Clc1cscc1Oc1cccc(Cl)c1Cl.
What is the InChIKey of 3-chloro-4-(2,3-dichlorophenoxy)thiophene?
The InChIKey is VWOQUNXOBXLCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl3OS/c11-6-2-1-3-8(10(6)13)14-9-5-15-4-7(9)12/h1-5H.
What are the key properties of 3-chloro-4-(2,3-dichlorophenoxy)thiophene?
3-chloro-4-(2,3-dichlorophenoxy)thiophene has a molecular weight of 279.57 g/mol, XLogP of 5.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-(2,3-dichlorophenoxy)thiophene is sourced from PubChem (CID 173291739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).