1-tert-butyl-9H-fluoren-9-ol

C17H18O — CID 126502935

IUPAC1-tert-butyl-9H-fluoren-9-ol
SMILESCC(C)(C)c1cccc2c1C(O)c1ccccc1-2
InChIInChI=1S/C17H18O/c1-17(2,3)14-10-6-9-12-11-7-4-5-8-13(11)16(18)15(12)14/h4-10,16,18H,1-3H3
InChIKeyMFLSDMAOCNFEOI-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.05
Rot. Bonds

About 1-tert-butyl-9H-fluoren-9-ol

1-tert-butyl-9H-fluoren-9-ol (PubChem CID 126502935) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-tert-butyl-9H-fluoren-9-ol.

Molecular Properties

Compound Name1-tert-butyl-9H-fluoren-9-ol
PubChem CID126502935
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-tert-butyl-9H-fluoren-9-ol
SMILESCC(C)(C)c1cccc2c1C(O)c1ccccc1-2
InChIInChI=1S/C17H18O/c1-17(2,3)14-10-6-9-12-11-7-4-5-8-13(11)16(18)15(12)14/h4-10,16,18H,1-3H3
InChIKeyMFLSDMAOCNFEOI-UHFFFAOYSA-N
XLogP4.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-9H-fluoren-9-ol?
The IUPAC name of 1-tert-butyl-9H-fluoren-9-ol (CID 126502935) is 1-tert-butyl-9H-fluoren-9-ol.
What is the SMILES notation for 1-tert-butyl-9H-fluoren-9-ol?
The canonical SMILES for 1-tert-butyl-9H-fluoren-9-ol is CC(C)(C)c1cccc2c1C(O)c1ccccc1-2.
What is the InChIKey of 1-tert-butyl-9H-fluoren-9-ol?
The InChIKey is MFLSDMAOCNFEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-17(2,3)14-10-6-9-12-11-7-4-5-8-13(11)16(18)15(12)14/h4-10,16,18H,1-3H3.
What are the key properties of 1-tert-butyl-9H-fluoren-9-ol?
1-tert-butyl-9H-fluoren-9-ol has a molecular weight of 238.33 g/mol, XLogP of 4.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-9H-fluoren-9-ol is sourced from PubChem (CID 126502935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).