3-(2-methylphenyl)cyclobutan-1-ol

C11H14O — CID 60792741

IUPAC3-(2-methylphenyl)cyclobutan-1-ol
SMILESCc1ccccc1C1CC(O)C1
InChIInChI=1S/C11H14O/c1-8-4-2-3-5-11(8)9-6-10(12)7-9/h2-5,9-10,12H,6-7H2,1H3
InChIKeyPBPRDGNILHOFAK-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.23
Rot. Bonds1

About 3-(2-methylphenyl)cyclobutan-1-ol

3-(2-methylphenyl)cyclobutan-1-ol (PubChem CID 60792741) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 3-(2-methylphenyl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-(2-methylphenyl)cyclobutan-1-ol
PubChem CID60792741
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name3-(2-methylphenyl)cyclobutan-1-ol
SMILESCc1ccccc1C1CC(O)C1
InChIInChI=1S/C11H14O/c1-8-4-2-3-5-11(8)9-6-10(12)7-9/h2-5,9-10,12H,6-7H2,1H3
InChIKeyPBPRDGNILHOFAK-UHFFFAOYSA-N
XLogP2.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylphenyl)cyclobutan-1-ol?
The IUPAC name of 3-(2-methylphenyl)cyclobutan-1-ol (CID 60792741) is 3-(2-methylphenyl)cyclobutan-1-ol.
What is the SMILES notation for 3-(2-methylphenyl)cyclobutan-1-ol?
The canonical SMILES for 3-(2-methylphenyl)cyclobutan-1-ol is Cc1ccccc1C1CC(O)C1.
What is the InChIKey of 3-(2-methylphenyl)cyclobutan-1-ol?
The InChIKey is PBPRDGNILHOFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-8-4-2-3-5-11(8)9-6-10(12)7-9/h2-5,9-10,12H,6-7H2,1H3.
What are the key properties of 3-(2-methylphenyl)cyclobutan-1-ol?
3-(2-methylphenyl)cyclobutan-1-ol has a molecular weight of 162.23 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylphenyl)cyclobutan-1-ol is sourced from PubChem (CID 60792741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).