3-(2,3-dimethylphenoxy)thiophene

C12H12OS — CID 173291828

IUPAC3-(2,3-dimethylphenoxy)thiophene
SMILESCc1cccc(Oc2ccsc2)c1C
InChIInChI=1S/C12H12OS/c1-9-4-3-5-12(10(9)2)13-11-6-7-14-8-11/h3-8H,1-2H3
InChIKeyRJMWJKIRNPRJCQ-UHFFFAOYSA-N
MW204.29 g/mol
LogP4.16
Rot. Bonds2

About 3-(2,3-dimethylphenoxy)thiophene

3-(2,3-dimethylphenoxy)thiophene (PubChem CID 173291828) has the molecular formula C12H12OS and a molecular weight of 204.29 g/mol. Its IUPAC name is 3-(2,3-dimethylphenoxy)thiophene.

Molecular Properties

Compound Name3-(2,3-dimethylphenoxy)thiophene
PubChem CID173291828
Molecular FormulaC12H12OS
Molecular Weight204.29 g/mol
Exact Mass204.06
IUPAC Name3-(2,3-dimethylphenoxy)thiophene
SMILESCc1cccc(Oc2ccsc2)c1C
InChIInChI=1S/C12H12OS/c1-9-4-3-5-12(10(9)2)13-11-6-7-14-8-11/h3-8H,1-2H3
InChIKeyRJMWJKIRNPRJCQ-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-thiophen-3-yloxybenzenethiol
CID 175029104
2-(2,3-dimethylphenoxy)thiophene
CID 151721860
4-(2,3-dimethylphenoxy)-N,N-dimethylaniline
CID 59069197
[4-(2,3-dimethylphenoxy)phenyl]methanol
CID 28946045
4-(2,3-dimethylphenoxy)benzoic acid
CID 20987074
N-[2-(2,3-dimethylphenoxy)ethyl]-2-thiophen-3-ylethanamine
CID 55088359
4-(2,3-dimethylphenoxy)-2-methoxyaniline
CID 63677998
1-(2,5-dimethylphenoxy)-2,3-dimethylbenzene
CID 19792455
5-(2,3-dimethylphenoxy)-N-methylpyridin-3-amine
CID 104536353
1-[4-(2,3-dimethylphenoxy)phenyl]propan-1-one
CID 114065883
4-(2,3-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43188261
1-(2,3-dimethylphenoxy)-2-methoxy-3,4-dimethylbenzene
CID 91665025

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylphenoxy)thiophene?
The IUPAC name of 3-(2,3-dimethylphenoxy)thiophene (CID 173291828) is 3-(2,3-dimethylphenoxy)thiophene.
What is the SMILES notation for 3-(2,3-dimethylphenoxy)thiophene?
The canonical SMILES for 3-(2,3-dimethylphenoxy)thiophene is Cc1cccc(Oc2ccsc2)c1C.
What is the InChIKey of 3-(2,3-dimethylphenoxy)thiophene?
The InChIKey is RJMWJKIRNPRJCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12OS/c1-9-4-3-5-12(10(9)2)13-11-6-7-14-8-11/h3-8H,1-2H3.
What are the key properties of 3-(2,3-dimethylphenoxy)thiophene?
3-(2,3-dimethylphenoxy)thiophene has a molecular weight of 204.29 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylphenoxy)thiophene is sourced from PubChem (CID 173291828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).