2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one

C18H18O2 — CID 177311617

IUPAC2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one
SMILESCc1ccc2c(c1)-c1cc(C(=O)C(C)(C)O)ccc1C2
InChIInChI=1S/C18H18O2/c1-11-4-5-12-9-13-6-7-14(17(19)18(2,3)20)10-16(13)15(12)8-11/h4-8,10,20H,9H2,1-3H3
InChIKeyLFSURMUXRJYHKZ-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.52
Rot. Bonds2

About 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one

2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one (PubChem CID 177311617) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one.

Molecular Properties

Compound Name2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one
PubChem CID177311617
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Name2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one
SMILESCc1ccc2c(c1)-c1cc(C(=O)C(C)(C)O)ccc1C2
InChIInChI=1S/C18H18O2/c1-11-4-5-12-9-13-6-7-14(17(19)18(2,3)20)10-16(13)15(12)8-11/h4-8,10,20H,9H2,1-3H3
InChIKeyLFSURMUXRJYHKZ-UHFFFAOYSA-N
XLogP3.52
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one?
The IUPAC name of 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one (CID 177311617) is 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one.
What is the SMILES notation for 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one?
The canonical SMILES for 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one is Cc1ccc2c(c1)-c1cc(C(=O)C(C)(C)O)ccc1C2.
What is the InChIKey of 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one?
The InChIKey is LFSURMUXRJYHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c1-11-4-5-12-9-13-6-7-14(17(19)18(2,3)20)10-16(13)15(12)8-11/h4-8,10,20H,9H2,1-3H3.
What are the key properties of 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one?
2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one has a molecular weight of 266.34 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-1-(6-methyl-9H-fluoren-3-yl)propan-1-one is sourced from PubChem (CID 177311617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).