4-methylsulfanylcyclohex-3-en-1-ol

C7H12OS — CID 89484285

IUPAC4-methylsulfanylcyclohex-3-en-1-ol
SMILESCSC1=CCC(O)CC1
InChIInChI=1S/C7H12OS/c1-9-7-4-2-6(8)3-5-7/h4,6,8H,2-3,5H2,1H3
InChIKeyCZXPKXSJJGYATP-UHFFFAOYSA-N
MW144.24 g/mol
LogP1.78
Rot. Bonds1

About 4-methylsulfanylcyclohex-3-en-1-ol

4-methylsulfanylcyclohex-3-en-1-ol (PubChem CID 89484285) has the molecular formula C7H12OS and a molecular weight of 144.24 g/mol. Its IUPAC name is 4-methylsulfanylcyclohex-3-en-1-ol.

Molecular Properties

Compound Name4-methylsulfanylcyclohex-3-en-1-ol
PubChem CID89484285
Molecular FormulaC7H12OS
Molecular Weight144.24 g/mol
Exact Mass144.06
IUPAC Name4-methylsulfanylcyclohex-3-en-1-ol
SMILESCSC1=CCC(O)CC1
InChIInChI=1S/C7H12OS/c1-9-7-4-2-6(8)3-5-7/h4,6,8H,2-3,5H2,1H3
InChIKeyCZXPKXSJJGYATP-UHFFFAOYSA-N
XLogP1.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methylsulfanylcyclohex-3-en-1-ol?
The IUPAC name of 4-methylsulfanylcyclohex-3-en-1-ol (CID 89484285) is 4-methylsulfanylcyclohex-3-en-1-ol.
What is the SMILES notation for 4-methylsulfanylcyclohex-3-en-1-ol?
The canonical SMILES for 4-methylsulfanylcyclohex-3-en-1-ol is CSC1=CCC(O)CC1.
What is the InChIKey of 4-methylsulfanylcyclohex-3-en-1-ol?
The InChIKey is CZXPKXSJJGYATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12OS/c1-9-7-4-2-6(8)3-5-7/h4,6,8H,2-3,5H2,1H3.
What are the key properties of 4-methylsulfanylcyclohex-3-en-1-ol?
4-methylsulfanylcyclohex-3-en-1-ol has a molecular weight of 144.24 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsulfanylcyclohex-3-en-1-ol is sourced from PubChem (CID 89484285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).