2-(4-bromophenyl)-4-ethylhexane-2,4-diol

CAS: 21133-89-1

Molecular Formula	`C14H21BrO2`
Molecular Weight	301.22 g/mol
LogP	3.3
Topological Polar Surface Area	40.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	5
Exact Mass	300.07248
Heavy Atoms	17
Complexity	232.0

Chemical Identifiers

CAS Number	21133-89-1
SMILES	`CCC(CC)(CC(C)(C1=CC=C(C=C1)Br)O)O`
InChIKey	`LJESTSRMCGGACG-UHFFFAOYSA-N`

📖 Product Overview

2-(4-bromophenyl)-4-ethylhexane-2,4-diol (CAS: 21133-89-1) is a chemical compound with molecular formula C14H21BrO2 and molecular weight 301.22 g/mol. Its IUPAC systematic name is 2-(4-bromophenyl)-4-ethylhexane-2,4-diol. LogP 3.3 Topological Polar Surface Area 40.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 5 Exact Mass 300.07248 Heavy Atoms 17 Complexity 232.0 InChI Key: LJESTSRMCGGACG-UHFFFAOYSA-N. SMILES: CCC(CC)(CC(C)(C1=CC=C(C=C1)Br)O)O.

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