2-(5-chlorothiophen-2-yl)ethanol

C6H7ClOS — CID 63967770

IUPAC2-(5-chlorothiophen-2-yl)ethanol
SMILESOCCc1ccc(Cl)s1
InChIInChI=1S/C6H7ClOS/c7-6-2-1-5(9-6)3-4-8/h1-2,8H,3-4H2
InChIKeyFFPYIDHZXPSZRQ-UHFFFAOYSA-N
MW162.64 g/mol
LogP1.94
Rot. Bonds2

About 2-(5-chlorothiophen-2-yl)ethanol

2-(5-chlorothiophen-2-yl)ethanol (PubChem CID 63967770) has the molecular formula C6H7ClOS and a molecular weight of 162.64 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)ethanol
PubChem CID63967770
Molecular FormulaC6H7ClOS
Molecular Weight162.64 g/mol
Exact Mass161.99
IUPAC Name2-(5-chlorothiophen-2-yl)ethanol
SMILESOCCc1ccc(Cl)s1
InChIInChI=1S/C6H7ClOS/c7-6-2-1-5(9-6)3-4-8/h1-2,8H,3-4H2
InChIKeyFFPYIDHZXPSZRQ-UHFFFAOYSA-N
XLogP1.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.64
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 79400
CID 79400
CID 15361441
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CID 12554178
CID 12554178
CID 67154484
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CID 123290972
CID 123290972
CID 818999
CID 818999
CID 22134638
CID 22134638
CID 67925992
CID 67925992
CID 105425187
CID 105425187
CID 164517317
CID 164517317
CID 162415142
CID 162415142
CID 61086874
CID 61086874

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)ethanol?
The IUPAC name of 2-(5-chlorothiophen-2-yl)ethanol (CID 63967770) is 2-(5-chlorothiophen-2-yl)ethanol.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)ethanol?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)ethanol is OCCc1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)ethanol?
The InChIKey is FFPYIDHZXPSZRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClOS/c7-6-2-1-5(9-6)3-4-8/h1-2,8H,3-4H2.
What are the key properties of 2-(5-chlorothiophen-2-yl)ethanol?
2-(5-chlorothiophen-2-yl)ethanol has a molecular weight of 162.64 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)ethanol is sourced from PubChem (CID 63967770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).