(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid

C16H11FO3 — CID 82578784

IUPAC(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid
SMILESCOc1ccc2c(c1)/C(=C/C(=O)O)c1cc(F)ccc1-2
InChIInChI=1S/C16H11FO3/c1-20-10-3-5-12-11-4-2-9(17)6-13(11)15(8-16(18)19)14(12)7-10/h2-8H,1H3,(H,18,19)/b15-8+
InChIKeyGSQPWRQJFBFGFW-OVCLIPMQSA-N
MW270.26 g/mol
LogP3.33
Rot. Bonds2

About (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid

(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid (PubChem CID 82578784) has the molecular formula C16H11FO3 and a molecular weight of 270.26 g/mol. Its IUPAC name is (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid.

Molecular Properties

Compound Name(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid
PubChem CID82578784
Molecular FormulaC16H11FO3
Molecular Weight270.26 g/mol
Exact Mass270.07
IUPAC Name(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid
SMILESCOc1ccc2c(c1)/C(=C/C(=O)O)c1cc(F)ccc1-2
InChIInChI=1S/C16H11FO3/c1-20-10-3-5-12-11-4-2-9(17)6-13(11)15(8-16(18)19)14(12)7-10/h2-8H,1H3,(H,18,19)/b15-8+
InChIKeyGSQPWRQJFBFGFW-OVCLIPMQSA-N
XLogP3.33
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2Z)-2-(5-fluoro-2-methoxyfluoren-9-ylidene)acetic acid
CID 82578770
(2Z)-2-(2-fluorofluoren-9-ylidene)acetic acid
CID 82578717
4-fluoro-2-(4-methoxy-2-methylphenyl)benzoic acid
CID 53211212
(9Z)-9-(hydroxymethylidene)-7-methoxyfluorene-2-carboxylic acid
CID 163301267
2-(2-chloro-5-methoxyphenyl)-5-fluorobenzoic acid
CID 53227485
2-(4-fluoro-2-methylphenyl)-5-methoxybenzoic acid
CID 54912716
2-(4-fluorophenyl)-5-methoxybenzoic acid
CID 15461737
1-[2-(2,5-dimethoxyphenyl)-5-fluorophenyl]ethanone
CID 175647048
(Z)-3-(3,5-difluorophenyl)-3-(4-methoxyphenyl)prop-2-enoic acid
CID 19421507
2-[6-fluoro-3-[(4-methoxyphenyl)methylidene]-2-methylinden-1-yl]acetic acid
CID 54372171
1-[2-(2,4-dimethoxyphenyl)-5-fluorophenyl]ethanone
CID 175647044
2-(3,5-dimethoxyphenyl)-4-fluorobenzoic acid
CID 53227277

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid?
The IUPAC name of (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid (CID 82578784) is (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid.
What is the SMILES notation for (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid?
The canonical SMILES for (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid is COc1ccc2c(c1)/C(=C/C(=O)O)c1cc(F)ccc1-2.
What is the InChIKey of (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid?
The InChIKey is GSQPWRQJFBFGFW-OVCLIPMQSA-N. The full InChI is InChI=1S/C16H11FO3/c1-20-10-3-5-12-11-4-2-9(17)6-13(11)15(8-16(18)19)14(12)7-10/h2-8H,1H3,(H,18,19)/b15-8+.
What are the key properties of (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid?
(2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid has a molecular weight of 270.26 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(2-fluoro-7-methoxyfluoren-9-ylidene)acetic acid is sourced from PubChem (CID 82578784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).