2'-fluorospiro[cyclohexane-1,9'-fluorene]

C18H17F — CID 18740734

IUPAC2'-fluorospiro[cyclohexane-1,9'-fluorene]
SMILESFc1ccc2c(c1)C1(CCCCC1)c1ccccc1-2
InChIInChI=1S/C18H17F/c19-13-8-9-15-14-6-2-3-7-16(14)18(17(15)12-13)10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2
InChIKeyYTIKUJIENUTVGY-UHFFFAOYSA-N
MW252.33 g/mol
LogP5.06
Rot. Bonds

About 2'-fluorospiro[cyclohexane-1,9'-fluorene]

2'-fluorospiro[cyclohexane-1,9'-fluorene] (PubChem CID 18740734) has the molecular formula C18H17F and a molecular weight of 252.33 g/mol. Its IUPAC name is 2'-fluorospiro[cyclohexane-1,9'-fluorene].

Molecular Properties

Compound Name2'-fluorospiro[cyclohexane-1,9'-fluorene]
PubChem CID18740734
Molecular FormulaC18H17F
Molecular Weight252.33 g/mol
Exact Mass252.13
IUPAC Name2'-fluorospiro[cyclohexane-1,9'-fluorene]
SMILESFc1ccc2c(c1)C1(CCCCC1)c1ccccc1-2
InChIInChI=1S/C18H17F/c19-13-8-9-15-14-6-2-3-7-16(14)18(17(15)12-13)10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2
InChIKeyYTIKUJIENUTVGY-UHFFFAOYSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.33
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2'-fluorospiro[cyclohexane-1,9'-fluorene]?
The IUPAC name of 2'-fluorospiro[cyclohexane-1,9'-fluorene] (CID 18740734) is 2'-fluorospiro[cyclohexane-1,9'-fluorene].
What is the SMILES notation for 2'-fluorospiro[cyclohexane-1,9'-fluorene]?
The canonical SMILES for 2'-fluorospiro[cyclohexane-1,9'-fluorene] is Fc1ccc2c(c1)C1(CCCCC1)c1ccccc1-2.
What is the InChIKey of 2'-fluorospiro[cyclohexane-1,9'-fluorene]?
The InChIKey is YTIKUJIENUTVGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F/c19-13-8-9-15-14-6-2-3-7-16(14)18(17(15)12-13)10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2.
What are the key properties of 2'-fluorospiro[cyclohexane-1,9'-fluorene]?
2'-fluorospiro[cyclohexane-1,9'-fluorene] has a molecular weight of 252.33 g/mol, XLogP of 5.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-fluorospiro[cyclohexane-1,9'-fluorene] is sourced from PubChem (CID 18740734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).