2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol

C8H11FO — CID 23450548

IUPAC2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol
SMILESOC(F)C1CC2C=CC1C2
InChIInChI=1S/C8H11FO/c9-8(10)7-4-5-1-2-6(7)3-5/h1-2,5-8,10H,3-4H2
InChIKeyAEGLRLIIBZKGFP-UHFFFAOYSA-N
MW142.17 g/mol
LogP1.49
Rot. Bonds1

About 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol

2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol (PubChem CID 23450548) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol
PubChem CID23450548
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol
SMILESOC(F)C1CC2C=CC1C2
InChIInChI=1S/C8H11FO/c9-8(10)7-4-5-1-2-6(7)3-5/h1-2,5-8,10H,3-4H2
InChIKeyAEGLRLIIBZKGFP-UHFFFAOYSA-N
XLogP1.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Bicyclo(2.2.1)hept-5-ene-2-methanol
CID 78946
5-Norbornene-2,3-dimethanol
CID 97724
4,4-Di(hydroxymethyl)bicyclo(2.2.1)heptene
CID 110917
2-Methyl-5-norbornene-2-methanol
CID 98088
5-Norbornene-2-exo,3-exo-dimethanol
CID 11862151
5-Norbornene-2-endo,3-endo-dimethanol
CID 10773190
(5R)-5-Hydroxymethylbicyclo[2.2.1]hept-2-ene
CID 12268643
Norborna-5-ene-2alpha,3alpha-dimethanol
CID 12253651
Unii-B4Q97fdn44
CID 6579449
7-Bicyclo[2.2.1]hept-2-enylmethanol
CID 296911
Bicyclo(2.2.1)hept-5-ene-2-ethanol
CID 548681
alpha-Methylbicyclo(2.2.1)hept-5-ene-2-methanol
CID 114494

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol (CID 23450548) is 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol is OC(F)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol?
The InChIKey is AEGLRLIIBZKGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FO/c9-8(10)7-4-5-1-2-6(7)3-5/h1-2,5-8,10H,3-4H2.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol?
2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol has a molecular weight of 142.17 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enyl(fluoro)methanol is sourced from PubChem (CID 23450548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).