1-(2,5-dimethylphenyl)-9H-fluoren-9-ol

C21H18O — CID 141056407

IUPAC1-(2,5-dimethylphenyl)-9H-fluoren-9-ol
SMILESCc1ccc(C)c(-c2cccc3c2C(O)c2ccccc2-3)c1
InChIInChI=1S/C21H18O/c1-13-10-11-14(2)19(12-13)17-9-5-8-16-15-6-3-4-7-18(15)21(22)20(16)17/h3-12,21-22H,1-2H3
InChIKeyRYCOJDBDNDRLKI-UHFFFAOYSA-N
MW286.37 g/mol
LogP5.03
Rot. Bonds1

About 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol

1-(2,5-dimethylphenyl)-9H-fluoren-9-ol (PubChem CID 141056407) has the molecular formula C21H18O and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-9H-fluoren-9-ol
PubChem CID141056407
Molecular FormulaC21H18O
Molecular Weight286.37 g/mol
Exact Mass286.14
IUPAC Name1-(2,5-dimethylphenyl)-9H-fluoren-9-ol
SMILESCc1ccc(C)c(-c2cccc3c2C(O)c2ccccc2-3)c1
InChIInChI=1S/C21H18O/c1-13-10-11-14(2)19(12-13)17-9-5-8-16-15-6-3-4-7-18(15)21(22)20(16)17/h3-12,21-22H,1-2H3
InChIKeyRYCOJDBDNDRLKI-UHFFFAOYSA-N
XLogP5.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.37
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol?
The IUPAC name of 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol (CID 141056407) is 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol?
The canonical SMILES for 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol is Cc1ccc(C)c(-c2cccc3c2C(O)c2ccccc2-3)c1.
What is the InChIKey of 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol?
The InChIKey is RYCOJDBDNDRLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18O/c1-13-10-11-14(2)19(12-13)17-9-5-8-16-15-6-3-4-7-18(15)21(22)20(16)17/h3-12,21-22H,1-2H3.
What are the key properties of 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol?
1-(2,5-dimethylphenyl)-9H-fluoren-9-ol has a molecular weight of 286.37 g/mol, XLogP of 5.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-9H-fluoren-9-ol is sourced from PubChem (CID 141056407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).