ethanol;thiophene

C6H10OS — CID 18400205

IUPACethanol;thiophene
SMILESCCO.c1ccsc1
InChIInChI=1S/C4H4S.C2H6O/c1-2-4-5-3-1;1-2-3/h1-4H;3H,2H2,1H3
InChIKeyKJIVPELWGRZLKM-UHFFFAOYSA-N
MW130.21 g/mol
LogP1.75
Rot. Bonds

About ethanol;thiophene

ethanol;thiophene (PubChem CID 18400205) has the molecular formula C6H10OS and a molecular weight of 130.21 g/mol. Its IUPAC name is ethanol;thiophene.

Molecular Properties

Compound Nameethanol;thiophene
PubChem CID18400205
Molecular FormulaC6H10OS
Molecular Weight130.21 g/mol
Exact Mass130.05
IUPAC Nameethanol;thiophene
SMILESCCO.c1ccsc1
InChIInChI=1S/C4H4S.C2H6O/c1-2-4-5-3-1;1-2-3/h1-4H;3H,2H2,1H3
InChIKeyKJIVPELWGRZLKM-UHFFFAOYSA-N
XLogP1.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethanol;thiophene?
The IUPAC name of ethanol;thiophene (CID 18400205) is ethanol;thiophene.
What is the SMILES notation for ethanol;thiophene?
The canonical SMILES for ethanol;thiophene is CCO.c1ccsc1.
What is the InChIKey of ethanol;thiophene?
The InChIKey is KJIVPELWGRZLKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4S.C2H6O/c1-2-4-5-3-1;1-2-3/h1-4H;3H,2H2,1H3.
What are the key properties of ethanol;thiophene?
ethanol;thiophene has a molecular weight of 130.21 g/mol, XLogP of 1.75, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;thiophene is sourced from PubChem (CID 18400205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).