2-Ethoxy-4- (3-hydroxybutyl) phenol

CAT: 0926-IBC09106-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-IBC09106-01Size:0.5 g

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CAS Number

1283091-06-4

MDL Number

MFCD21324587

Smiles

CCOC1=C (C=CC (=C1) CCC (C) O) O

Molecular Formula

C12H18O3

Molecular Weight

210.27 g/mol

Controlled

Chemical Information

2-Ethoxy-4-(3-hydroxybutyl)phenol

CAS Number	1283091-06-4
PubChem CID	52918662
IUPAC Name	2-ethoxy-4-(3-hydroxybutyl)phenol
Molecular Formula	C12H18O3
Molecular Weight	210.27
XLogP	1.6
Topological Polar Surface Area	49.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	15
Formal Charge	0
Complexity	172

SMILES

CCOC1=C(C=CC(=C1)CCC(C)O)O

InChI

InChI=1S/C12H18O3/c1-3-15-12-8-10(5-4-9(2)13)6-7-11(12)14/h6-9,13-14H,3-5H2,1-2H3

InChIKey

URXXRBYISKXBBJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1283091-06-4

CID: 52918662

Formula: C12H18O3

MW: 210.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	210.27
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	210.125594432
Monoisotopic Mass	210.125594432
Topological Polar Surface Area	49.7 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	172
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
LHA36571-01	4-{2-[2- (2-Methoxyethoxy) ethoxy]ethoxy}phenol
FD150040-01	[4-[2- (Diethylamino) ethoxy]-3-iodophenyl][2- (1-hydroxybutyl) -3-benzofuranyl]-methanone
FKA73450-01	2-Ethoxy-4- (2-hydroxyethyl) phenol
JBA18493-01	2-Ethoxy-4-[ (hydroxyimino) methyl]phenol
HJB19887-01	4-[2- (Methylamino) ethoxy]phenol hydrochloride
MRD34086-01	4-[2- (Dimethylamino) ethoxy]phenol hydrochloride
RFA67325-01	4-[2- (Morpholin-4-yl) ethoxy]phenol
UTB37022-01	2-Methyl-3-[2- (morpholin-4-yl) ethoxy]phenol
AEA22101-01	4-[2- (4-Methylpiperazin-1-yl) ethoxy]phenol
YAA87768-01	4-[2- (Pyrrolidin-1-yl) ethoxy]phenol

Catalog	Name
sc-347858	4- (3-hydroxybutyl) phenol
RG-A261282-01	4- (4-Hydroxybutyl) Phenol
OR957541	3-Chloro-4-ethoxy-phenol
PC302647-01	4-Ethoxy-3- (trifluoromethyl) phenol
424293-01	3-Bromo-4-ethoxy-phenol
GTR19222965-01	Phenol, 3- (2- (acetyloxy) ethoxy) -
MBS5783510	Phenol, 3-(2-(acetyloxy)ethoxy)-
OR1065406-01	2-Ethoxy-4- (4-methyl-1,3-dioxolan-2-yl) phenol
PC502559	3-[1,1,2,2-Tetrafluoro-2- (4-fluorophenyl) ethoxy]phenol
PC1013901	3-Ethoxy-5- (trifluoromethyl) phenol