2-(9-oxofluoren-1-yl)acetic acid

C15H10O3 — CID 12692062

IUPAC2-(9-oxofluoren-1-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1C(=O)c1ccccc1-2
InChIInChI=1S/C15H10O3/c16-13(17)8-9-4-3-7-11-10-5-1-2-6-12(10)15(18)14(9)11/h1-7H,8H2,(H,16,17)
InChIKeyBFLZBNKBIUILNJ-UHFFFAOYSA-N
MW238.24 g/mol
LogP2.53
Rot. Bonds2

About 2-(9-oxofluoren-1-yl)acetic acid

2-(9-oxofluoren-1-yl)acetic acid (PubChem CID 12692062) has the molecular formula C15H10O3 and a molecular weight of 238.24 g/mol. Its IUPAC name is 2-(9-oxofluoren-1-yl)acetic acid.

Molecular Properties

Compound Name2-(9-oxofluoren-1-yl)acetic acid
PubChem CID12692062
Molecular FormulaC15H10O3
Molecular Weight238.24 g/mol
Exact Mass238.06
IUPAC Name2-(9-oxofluoren-1-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1C(=O)c1ccccc1-2
InChIInChI=1S/C15H10O3/c16-13(17)8-9-4-3-7-11-10-5-1-2-6-12(10)15(18)14(9)11/h1-7H,8H2,(H,16,17)
InChIKeyBFLZBNKBIUILNJ-UHFFFAOYSA-N
XLogP2.53
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(9-oxofluoren-1-yl)acetic acid?
The IUPAC name of 2-(9-oxofluoren-1-yl)acetic acid (CID 12692062) is 2-(9-oxofluoren-1-yl)acetic acid.
What is the SMILES notation for 2-(9-oxofluoren-1-yl)acetic acid?
The canonical SMILES for 2-(9-oxofluoren-1-yl)acetic acid is O=C(O)Cc1cccc2c1C(=O)c1ccccc1-2.
What is the InChIKey of 2-(9-oxofluoren-1-yl)acetic acid?
The InChIKey is BFLZBNKBIUILNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O3/c16-13(17)8-9-4-3-7-11-10-5-1-2-6-12(10)15(18)14(9)11/h1-7H,8H2,(H,16,17).
What are the key properties of 2-(9-oxofluoren-1-yl)acetic acid?
2-(9-oxofluoren-1-yl)acetic acid has a molecular weight of 238.24 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-oxofluoren-1-yl)acetic acid is sourced from PubChem (CID 12692062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).