(1-fluorocyclobutyl)methanol

C5H9FO — CID 72698925

IUPAC(1-fluorocyclobutyl)methanol
SMILESOCC1(F)CCC1
InChIInChI=1S/C5H9FO/c6-5(4-7)2-1-3-5/h7H,1-4H2
InChIKeyKKIPAQKFWDBCFV-UHFFFAOYSA-N
MW104.12 g/mol
LogP0.87
Rot. Bonds1

About (1-fluorocyclobutyl)methanol

(1-fluorocyclobutyl)methanol (PubChem CID 72698925) has the molecular formula C5H9FO and a molecular weight of 104.12 g/mol. Its IUPAC name is (1-fluorocyclobutyl)methanol.

Molecular Properties

Compound Name(1-fluorocyclobutyl)methanol
PubChem CID72698925
Molecular FormulaC5H9FO
Molecular Weight104.12 g/mol
Exact Mass104.06
IUPAC Name(1-fluorocyclobutyl)methanol
SMILESOCC1(F)CCC1
InChIInChI=1S/C5H9FO/c6-5(4-7)2-1-3-5/h7H,1-4H2
InChIKeyKKIPAQKFWDBCFV-UHFFFAOYSA-N
XLogP0.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.12
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1-fluorocyclobutyl)methanol?
The IUPAC name of (1-fluorocyclobutyl)methanol (CID 72698925) is (1-fluorocyclobutyl)methanol.
What is the SMILES notation for (1-fluorocyclobutyl)methanol?
The canonical SMILES for (1-fluorocyclobutyl)methanol is OCC1(F)CCC1.
What is the InChIKey of (1-fluorocyclobutyl)methanol?
The InChIKey is KKIPAQKFWDBCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO/c6-5(4-7)2-1-3-5/h7H,1-4H2.
What are the key properties of (1-fluorocyclobutyl)methanol?
(1-fluorocyclobutyl)methanol has a molecular weight of 104.12 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-fluorocyclobutyl)methanol is sourced from PubChem (CID 72698925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).