4- (3-hydroxybutyl) phenol

CAT: 0024-sc-347858ASize: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-347858ASize:1 g

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CAS Number

69617-84-1

Chemical Information

Rhododendrol, (+-)-

4-(4-Hydroxyphenyl)-2-butanol is a member of phenols.

CAS Number	69617-84-1
PubChem CID	97790
IUPAC Name	4-(3-hydroxybutyl)phenol
Molecular Formula	C10H14O2
Molecular Weight	166.22
XLogP	1.9
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	117

SMILES

CC(CCC1=CC=C(C=C1)O)O

InChI

InChI=1S/C10H14O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-8,11-12H,2-3H2,1H3

InChIKey

SFUCGABQOMYVJW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 69617-84-1

CID: 97790

Formula: C10H14O2

MW: 166.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.22
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	166.099379685
Monoisotopic Mass	166.099379685
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	117
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
sc-226685	4-Hydroxybutyl acrylate
sc-485186	1,3-Bis (4-hydroxybutyl) tetramethyldisiloxane
sc-281866	1- (4-Hydroxybutyl) -4-methylpiperazine
sc-281866A	1- (4-Hydroxybutyl) -4-methylpiperazine
sc-484539	Mono (3-hydroxybutyl) phthalate
sc-500732	Dibutyl 3-Hydroxybutyl Phosphate
sc-495396	3- (4- (Hydroxymethyl) phenoxy) phenol
sc-486502	4- (4-Hydroxybutyl) thiomorpholine 1,1-Dioxide
sc-490507	4- (4-Hydroxybutyl) benzoic Acid Methyl Ester
sc-223611	4-[4- (Dimethylamino) -1- (4'-chlorophenyl) -1-hydroxybutyl]-3- (hydroxymethyl) -benzonitrile