4- (2-Ethyl-hexyloxy) -phenol

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CAS Number

35107-98-3

Molecular Formula

C14H22O2

Molecular Weight

222.32

Chemical Information

4-(2-Ethyl-hexyloxy)-phenol

CAS Number	35107-98-3
PubChem CID	18798340
IUPAC Name	4-(2-ethylhexoxy)phenol
Molecular Formula	C14H22O2
Molecular Weight	222.32
XLogP	4.7
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Heavy Atom Count	16
Formal Charge	0
Complexity	162

SMILES

CCCCC(CC)COC1=CC=C(C=C1)O

InChI

InChI=1S/C14H22O2/c1-3-5-6-12(4-2)11-16-14-9-7-13(15)8-10-14/h7-10,12,15H,3-6,11H2,1-2H3

InChIKey

ICYTWTCDUIQTJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 35107-98-3

CID: 18798340

Formula: C14H22O2

MW: 222.32

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	222.32
XLogP3	4.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	222.161979940
Monoisotopic Mass	222.161979940
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	162
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
JH522178	(S) -Octan-2-yl 4- ((4- (hexyloxy) benzoyl) oxy) benzoate
JH321450	4- (2-Methoxyethoxy) phenol
JH215484	4-[2- (4-hydroxyphenyl) ethynyl]phenol
JH376611	Ethyl 2,4-dioxovalerate
JH919817	2-[2- (6-chloro-hexyloxy) -ethoxy]-ethylamine hydrochloride
JH920211	2-Amino-4-[ (trifluoromethyl) thio]phenol
JH57898	4-[1-[4-[2- (methylamino) ethoxy]phenyl]-2-phenylbut-1-enyl]phenol
JH505811	Ethyl Phenyl(2,4,6-trimethylbenzoyl)phosphinate
JH295632	2-amino-4- (3-amino-4-hydroxyphenyl) phenol
JH113958	Ethyl penta-2,4-dienoate

Catalog	Name
sc-226416	4- (Hexyloxy) phenol
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A0201-07	4- (2-Acetoxy-ethyl) phenol
TRC-A165595-1G	4-(2-Acetoxy-ethyl)phenol
OR1038562	4- (2- (Cyclopropylmethoxy) ethyl) phenol
TRC-C988665-50MG	4-[2-(Cyclopropylmethoxy)ethyl]phenol
007361	4-[2- (Cyclopropylmethoxy) ethyl]phenol
TCA65811-01	2-Ethyl-6- (hydroxymethyl) phenol
OR1023376-01	4- (2- (Dimethylamino) Ethyl) Phenol
414648-01	2-[2- (3-Methoxyphenyl) ethyl]phenol