(1-cyclobutylcyclobutyl)methanol

C9H16O — CID 57318221

IUPAC(1-cyclobutylcyclobutyl)methanol
SMILESOCC1(C2CCC2)CCC1
InChIInChI=1S/C9H16O/c10-7-9(5-2-6-9)8-3-1-4-8/h8,10H,1-7H2
InChIKeyWWADGMARJYXIGJ-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.95
Rot. Bonds2

About (1-cyclobutylcyclobutyl)methanol

(1-cyclobutylcyclobutyl)methanol (PubChem CID 57318221) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (1-cyclobutylcyclobutyl)methanol.

Molecular Properties

Compound Name(1-cyclobutylcyclobutyl)methanol
PubChem CID57318221
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(1-cyclobutylcyclobutyl)methanol
SMILESOCC1(C2CCC2)CCC1
InChIInChI=1S/C9H16O/c10-7-9(5-2-6-9)8-3-1-4-8/h8,10H,1-7H2
InChIKeyWWADGMARJYXIGJ-UHFFFAOYSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1-cyclobutylcyclobutyl)methanol?
The IUPAC name of (1-cyclobutylcyclobutyl)methanol (CID 57318221) is (1-cyclobutylcyclobutyl)methanol.
What is the SMILES notation for (1-cyclobutylcyclobutyl)methanol?
The canonical SMILES for (1-cyclobutylcyclobutyl)methanol is OCC1(C2CCC2)CCC1.
What is the InChIKey of (1-cyclobutylcyclobutyl)methanol?
The InChIKey is WWADGMARJYXIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c10-7-9(5-2-6-9)8-3-1-4-8/h8,10H,1-7H2.
What are the key properties of (1-cyclobutylcyclobutyl)methanol?
(1-cyclobutylcyclobutyl)methanol has a molecular weight of 140.23 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclobutylcyclobutyl)methanol is sourced from PubChem (CID 57318221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).