(2-fluoro-4-methylidenecyclohexyl)methanol

C8H13FO — CID 91090559

IUPAC(2-fluoro-4-methylidenecyclohexyl)methanol
SMILESC=C1CCC(CO)C(F)C1
InChIInChI=1S/C8H13FO/c1-6-2-3-7(5-10)8(9)4-6/h7-8,10H,1-5H2
InChIKeyOARJASLSWBTMBC-UHFFFAOYSA-N
MW144.19 g/mol
LogP1.67
Rot. Bonds1

About (2-fluoro-4-methylidenecyclohexyl)methanol

(2-fluoro-4-methylidenecyclohexyl)methanol (PubChem CID 91090559) has the molecular formula C8H13FO and a molecular weight of 144.19 g/mol. Its IUPAC name is (2-fluoro-4-methylidenecyclohexyl)methanol.

Molecular Properties

Compound Name(2-fluoro-4-methylidenecyclohexyl)methanol
PubChem CID91090559
Molecular FormulaC8H13FO
Molecular Weight144.19 g/mol
Exact Mass144.10
IUPAC Name(2-fluoro-4-methylidenecyclohexyl)methanol
SMILESC=C1CCC(CO)C(F)C1
InChIInChI=1S/C8H13FO/c1-6-2-3-7(5-10)8(9)4-6/h7-8,10H,1-5H2
InChIKeyOARJASLSWBTMBC-UHFFFAOYSA-N
XLogP1.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 51.67
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-fluoro-4-methylidenecyclohexyl)methanol?
The IUPAC name of (2-fluoro-4-methylidenecyclohexyl)methanol (CID 91090559) is (2-fluoro-4-methylidenecyclohexyl)methanol.
What is the SMILES notation for (2-fluoro-4-methylidenecyclohexyl)methanol?
The canonical SMILES for (2-fluoro-4-methylidenecyclohexyl)methanol is C=C1CCC(CO)C(F)C1.
What is the InChIKey of (2-fluoro-4-methylidenecyclohexyl)methanol?
The InChIKey is OARJASLSWBTMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FO/c1-6-2-3-7(5-10)8(9)4-6/h7-8,10H,1-5H2.
What are the key properties of (2-fluoro-4-methylidenecyclohexyl)methanol?
(2-fluoro-4-methylidenecyclohexyl)methanol has a molecular weight of 144.19 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methylidenecyclohexyl)methanol is sourced from PubChem (CID 91090559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).