RefChem:67092

2-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]acetic acid

CAS: 81166-47-4

Molecular Formula	`C20H24Cl2O4`
Molecular Weight	399.3 g/mol
LogP	6.5
Topological Polar Surface Area	63.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	398.10516
Heavy Atoms	26
Complexity	534.0

Chemical Identifiers

CAS Number	81166-47-4
SMILES	`CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3CCCC3`
InChIKey	`YAWWQIFONIPBKT-UHFFFAOYSA-N`

📖 Product Overview

RefChem:67092 (CAS: 81166-47-4) is a chemical compound with molecular formula C20H24Cl2O4 and molecular weight 399.3 g/mol. Its IUPAC systematic name is 2-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]acetic acid. LogP 6.5 Topological Polar Surface Area 63.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 398.10516 Heavy Atoms 26 Complexity 534.0 InChI Key: YAWWQIFONIPBKT-UHFFFAOYSA-N. SMILES: CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3CCCC3.

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