(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid

C15H9FO2 — CID 82578717

IUPAC(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid
SMILESO=C(O)/C=C1/c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C15H9FO2/c16-9-5-6-12-10-3-1-2-4-11(10)14(8-15(17)18)13(12)7-9/h1-8H,(H,17,18)/b14-8-
InChIKeyKJHMKUBGIDIDRW-ZSOIEALJSA-N
MW240.23 g/mol
LogP3.32
Rot. Bonds1

About (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid

(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid (PubChem CID 82578717) has the molecular formula C15H9FO2 and a molecular weight of 240.23 g/mol. Its IUPAC name is (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid.

Molecular Properties

Compound Name(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid
PubChem CID82578717
Molecular FormulaC15H9FO2
Molecular Weight240.23 g/mol
Exact Mass240.06
IUPAC Name(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid
SMILESO=C(O)/C=C1/c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C15H9FO2/c16-9-5-6-12-10-3-1-2-4-11(10)14(8-15(17)18)13(12)7-9/h1-8H,(H,17,18)/b14-8-
InChIKeyKJHMKUBGIDIDRW-ZSOIEALJSA-N
XLogP3.32
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.23
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(2E)-2-(2-fluoro-5-hydroxyfluoren-9-ylidene)acetic acid
CID 82578786
(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid
CID 82578784
2-thioxanthen-9-ylideneacetic acid
CID 66958680
(2Z)-2-(5-fluoro-2-methoxyfluoren-9-ylidene)acetic acid
CID 82578770
(2E)-2-(5-fluoro-2,3-dihydroinden-1-ylidene)acetic acid
CID 23293571
(2E)-2-(6-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene)acetic acid
CID 20527496
4-fluoro-2-(2-fluorophenyl)benzoic acid
CID 46312310
4-fluoro-2-(2-methylsulfanylphenyl)benzoic acid
CID 53226362
4-fluoro-2-[2-(hydroxymethyl)phenyl]benzoic acid
CID 53225310
5-fluoro-2-(2-hydroxyphenyl)phenol
CID 53218535
2-fluoro-9H-fluorene-9-carboxylic acid
CID 14579584
2-fluoro-10-hydroxyphenanthrene-9-carboxylic acid
CID 174931024

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid?
The IUPAC name of (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid (CID 82578717) is (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid.
What is the SMILES notation for (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid?
The canonical SMILES for (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid is O=C(O)/C=C1/c2ccccc2-c2ccc(F)cc21.
What is the InChIKey of (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid?
The InChIKey is KJHMKUBGIDIDRW-ZSOIEALJSA-N. The full InChI is InChI=1S/C15H9FO2/c16-9-5-6-12-10-3-1-2-4-11(10)14(8-15(17)18)13(12)7-9/h1-8H,(H,17,18)/b14-8-.
What are the key properties of (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid?
(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid has a molecular weight of 240.23 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid is sourced from PubChem (CID 82578717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).