Compound C21H36O5

7-[3-hydroxy-2-(4-hydroxy-4-methyloct-1-enyl)-5-oxocyclopentyl]heptanoic acid

CAS: 112137-89-0

Molecular Formula	`C21H36O5`
Molecular Weight	368.5 g/mol
LogP	3.3
Topological Polar Surface Area	94.8 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	13
Exact Mass	368.2563
Heavy Atoms	26
Complexity	473.0

Chemical Identifiers

CAS Number	112137-89-0
SMILES	`CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O`
InChIKey	`CNWGPXZGIIOYDL-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H36O5 (CAS: 112137-89-0) is a chemical compound with molecular formula C21H36O5 and molecular weight 368.5 g/mol. Its IUPAC systematic name is 7-[3-hydroxy-2-(4-hydroxy-4-methyloct-1-enyl)-5-oxocyclopentyl]heptanoic acid. LogP 3.3 Topological Polar Surface Area 94.8 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 13 Exact Mass 368.2563 Heavy Atoms 26 Complexity 473.0 InChI Key: CNWGPXZGIIOYDL-UHFFFAOYSA-N. SMILES: CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O.

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