2-fluorospiro[fluorene-9,9'-xanthene]

C25H15FO — CID 167078422

IUPAC2-fluorospiro[fluorene-9,9'-xanthene]
SMILESFc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2
InChIInChI=1S/C25H15FO/c26-16-13-14-18-17-7-1-2-8-19(17)25(22(18)15-16)20-9-3-5-11-23(20)27-24-12-6-4-10-21(24)25/h1-15H
InChIKeyPOFBYAUJSPBIEB-UHFFFAOYSA-N
MW350.39 g/mol
LogP6.29
Rot. Bonds

About 2-fluorospiro[fluorene-9,9'-xanthene]

2-fluorospiro[fluorene-9,9'-xanthene] (PubChem CID 167078422) has the molecular formula C25H15FO and a molecular weight of 350.39 g/mol. Its IUPAC name is 2-fluorospiro[fluorene-9,9'-xanthene].

Molecular Properties

Compound Name2-fluorospiro[fluorene-9,9'-xanthene]
PubChem CID167078422
Molecular FormulaC25H15FO
Molecular Weight350.39 g/mol
Exact Mass350.11
IUPAC Name2-fluorospiro[fluorene-9,9'-xanthene]
SMILESFc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2
InChIInChI=1S/C25H15FO/c26-16-13-14-18-17-7-1-2-8-19(17)25(22(18)15-16)20-9-3-5-11-23(20)27-24-12-6-4-10-21(24)25/h1-15H
InChIKeyPOFBYAUJSPBIEB-UHFFFAOYSA-N
XLogP6.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.39
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-(9H-Xanthen-9-ylidene)-9H-xanthene
CID 68202
tFPO-CF2-3HitFB
CID 71811618
tFPO-CF2-2tFB
CID 71811620
tFPO-CF2-MetFB
CID 117962235
tFPO-CF2-HitFB
CID 118687154
tFPO-CF2-2HitFT
CID 134241696
tFPO-CF2-4HitFT
CID 134241697
tFPO-CF2-3HitFT
CID 134241699
tFPO-CF2-4HiFB
CID 134437849
tFPO-CF2-3HiFB
CID 134437850
tFPO-CF2-2HiFB
CID 134437852
9,9'-Bixanthene
CID 231107

Frequently Asked Questions

What is the IUPAC name of 2-fluorospiro[fluorene-9,9'-xanthene]?
The IUPAC name of 2-fluorospiro[fluorene-9,9'-xanthene] (CID 167078422) is 2-fluorospiro[fluorene-9,9'-xanthene].
What is the SMILES notation for 2-fluorospiro[fluorene-9,9'-xanthene]?
The canonical SMILES for 2-fluorospiro[fluorene-9,9'-xanthene] is Fc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2.
What is the InChIKey of 2-fluorospiro[fluorene-9,9'-xanthene]?
The InChIKey is POFBYAUJSPBIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15FO/c26-16-13-14-18-17-7-1-2-8-19(17)25(22(18)15-16)20-9-3-5-11-23(20)27-24-12-6-4-10-21(24)25/h1-15H.
What are the key properties of 2-fluorospiro[fluorene-9,9'-xanthene]?
2-fluorospiro[fluorene-9,9'-xanthene] has a molecular weight of 350.39 g/mol, XLogP of 6.29, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluorospiro[fluorene-9,9'-xanthene] is sourced from PubChem (CID 167078422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).