5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid

Name: 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₉H₁₅ClO₃ — CID 15391089

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid

SMILESO=C(O)C1=CCCC1C(=O)c1ccc(-c2ccc(Cl)cc2)cc1

InChIInChI=1S/C19H15ClO3/c20-15-10-8-13(9-11-15)12-4-6-14(7-5-12)18(21)16-2-1-3-17(16)19(22)23/h3-11,16H,1-2H2,(H,22,23)

InChIKeySGFFOJWHVXRTKD-UHFFFAOYSA-N

MW326.78 g/mol

LogP4.61

Rot. Bonds4

About 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid

5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid (PubChem CID 15391089) has the molecular formula C₁₉H₁₅ClO₃ and a molecular weight of 326.78 g/mol. Its IUPAC name is 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid.

Molecular Properties

Compound Name	5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid
PubChem CID	15391089
Molecular Formula	C₁₉H₁₅ClO₃
Molecular Weight	326.78 g/mol
Exact Mass	326.07
IUPAC Name	5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid
SMILES	O=C(O)C1=CCCC1C(=O)c1ccc(-c2ccc(Cl)cc2)cc1
InChI	InChI=1S/C19H15ClO3/c20-15-10-8-13(9-11-15)12-4-6-14(7-5-12)18(21)16-2-1-3-17(16)19(22)23/h3-11,16H,1-2H2,(H,22,23)
InChIKey	SGFFOJWHVXRTKD-UHFFFAOYSA-N
XLogP	4.61
TPSA	54.37 Å²
H-Bond Donors	1
H-Bond Acceptors	2
Rotatable Bonds	4
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	326.78
LogP ≤ 5	4.61
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid?

The IUPAC name of 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid (CID 15391089) is 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid.

What is the SMILES notation for 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid?

The canonical SMILES for 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid is O=C(O)C1=CCCC1C(=O)c1ccc(-c2ccc(Cl)cc2)cc1.

What is the InChIKey of 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid?

The InChIKey is SGFFOJWHVXRTKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClO3/c20-15-10-8-13(9-11-15)12-4-6-14(7-5-12)18(21)16-2-1-3-17(16)19(22)23/h3-11,16H,1-2H2,(H,22,23).

What are the key properties of 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid?

5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid has a molecular weight of 326.78 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4-(4-chlorophenyl)benzoyl]cyclopentene-1-carboxylic acid is sourced from PubChem (CID 15391089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 15391089 — identifiers, structure, computed properties (public domain)

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