(2,4,6-trimethylcyclohex-2-en-1-yl)methanol

C10H18O — CID 175543793

IUPAC(2,4,6-trimethylcyclohex-2-en-1-yl)methanol
SMILESCC1=CC(C)CC(C)C1CO
InChIInChI=1S/C10H18O/c1-7-4-8(2)10(6-11)9(3)5-7/h4,7,9-11H,5-6H2,1-3H3
InChIKeyUBGYWOVFWLXQHL-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.22
Rot. Bonds1

About (2,4,6-trimethylcyclohex-2-en-1-yl)methanol

(2,4,6-trimethylcyclohex-2-en-1-yl)methanol (PubChem CID 175543793) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (2,4,6-trimethylcyclohex-2-en-1-yl)methanol.

Molecular Properties

Compound Name(2,4,6-trimethylcyclohex-2-en-1-yl)methanol
PubChem CID175543793
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(2,4,6-trimethylcyclohex-2-en-1-yl)methanol
SMILESCC1=CC(C)CC(C)C1CO
InChIInChI=1S/C10H18O/c1-7-4-8(2)10(6-11)9(3)5-7/h4,7,9-11H,5-6H2,1-3H3
InChIKeyUBGYWOVFWLXQHL-UHFFFAOYSA-N
XLogP2.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2,4,6-trimethylcyclohex-2-en-1-yl)methanol?
The IUPAC name of (2,4,6-trimethylcyclohex-2-en-1-yl)methanol (CID 175543793) is (2,4,6-trimethylcyclohex-2-en-1-yl)methanol.
What is the SMILES notation for (2,4,6-trimethylcyclohex-2-en-1-yl)methanol?
The canonical SMILES for (2,4,6-trimethylcyclohex-2-en-1-yl)methanol is CC1=CC(C)CC(C)C1CO.
What is the InChIKey of (2,4,6-trimethylcyclohex-2-en-1-yl)methanol?
The InChIKey is UBGYWOVFWLXQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-7-4-8(2)10(6-11)9(3)5-7/h4,7,9-11H,5-6H2,1-3H3.
What are the key properties of (2,4,6-trimethylcyclohex-2-en-1-yl)methanol?
(2,4,6-trimethylcyclohex-2-en-1-yl)methanol has a molecular weight of 154.25 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4,6-trimethylcyclohex-2-en-1-yl)methanol is sourced from PubChem (CID 175543793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).