(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol

C8H10OS — CID 141415959

IUPAC(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol
SMILESCc1ccc(/C=C\CO)s1
InChIInChI=1S/C8H10OS/c1-7-4-5-8(10-7)3-2-6-9/h2-5,9H,6H2,1H3/b3-2-
InChIKeyPXMSLQARAIEWHF-IHWYPQMZSA-N
MW154.23 g/mol
LogP2.06
Rot. Bonds2

About (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol

(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol (PubChem CID 141415959) has the molecular formula C8H10OS and a molecular weight of 154.23 g/mol. Its IUPAC name is (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol
PubChem CID141415959
Molecular FormulaC8H10OS
Molecular Weight154.23 g/mol
Exact Mass154.05
IUPAC Name(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol
SMILESCc1ccc(/C=C\CO)s1
InChIInChI=1S/C8H10OS/c1-7-4-5-8(10-7)3-2-6-9/h2-5,9H,6H2,1H3/b3-2-
InChIKeyPXMSLQARAIEWHF-IHWYPQMZSA-N
XLogP2.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.23
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol?
The IUPAC name of (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol (CID 141415959) is (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol?
The canonical SMILES for (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol is Cc1ccc(/C=C\CO)s1.
What is the InChIKey of (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol?
The InChIKey is PXMSLQARAIEWHF-IHWYPQMZSA-N. The full InChI is InChI=1S/C8H10OS/c1-7-4-5-8(10-7)3-2-6-9/h2-5,9H,6H2,1H3/b3-2-.
What are the key properties of (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol?
(Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol has a molecular weight of 154.23 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(5-methylthiophen-2-yl)prop-2-en-1-ol is sourced from PubChem (CID 141415959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).