(2-methoxy-6-thiophen-3-ylphenyl)methanol

C12H12O2S — CID 172650507

IUPAC(2-methoxy-6-thiophen-3-ylphenyl)methanol
SMILESCOc1cccc(-c2ccsc2)c1CO
InChIInChI=1S/C12H12O2S/c1-14-12-4-2-3-10(11(12)7-13)9-5-6-15-8-9/h2-6,8,13H,7H2,1H3
InChIKeyBGUVWJNHKLIQPV-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.92
Rot. Bonds3

About (2-methoxy-6-thiophen-3-ylphenyl)methanol

(2-methoxy-6-thiophen-3-ylphenyl)methanol (PubChem CID 172650507) has the molecular formula C12H12O2S and a molecular weight of 220.29 g/mol. Its IUPAC name is (2-methoxy-6-thiophen-3-ylphenyl)methanol.

Molecular Properties

Compound Name(2-methoxy-6-thiophen-3-ylphenyl)methanol
PubChem CID172650507
Molecular FormulaC12H12O2S
Molecular Weight220.29 g/mol
Exact Mass220.06
IUPAC Name(2-methoxy-6-thiophen-3-ylphenyl)methanol
SMILESCOc1cccc(-c2ccsc2)c1CO
InChIInChI=1S/C12H12O2S/c1-14-12-4-2-3-10(11(12)7-13)9-5-6-15-8-9/h2-6,8,13H,7H2,1H3
InChIKeyBGUVWJNHKLIQPV-UHFFFAOYSA-N
XLogP2.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methoxy-6-thiophen-3-ylphenyl)methanol?
The IUPAC name of (2-methoxy-6-thiophen-3-ylphenyl)methanol (CID 172650507) is (2-methoxy-6-thiophen-3-ylphenyl)methanol.
What is the SMILES notation for (2-methoxy-6-thiophen-3-ylphenyl)methanol?
The canonical SMILES for (2-methoxy-6-thiophen-3-ylphenyl)methanol is COc1cccc(-c2ccsc2)c1CO.
What is the InChIKey of (2-methoxy-6-thiophen-3-ylphenyl)methanol?
The InChIKey is BGUVWJNHKLIQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2S/c1-14-12-4-2-3-10(11(12)7-13)9-5-6-15-8-9/h2-6,8,13H,7H2,1H3.
What are the key properties of (2-methoxy-6-thiophen-3-ylphenyl)methanol?
(2-methoxy-6-thiophen-3-ylphenyl)methanol has a molecular weight of 220.29 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-6-thiophen-3-ylphenyl)methanol is sourced from PubChem (CID 172650507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).