2'-Hydroxyacetophenone

CAT: 0931-TCS1856-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No

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CAT#:0931-TCS1856-01Size:1 mL - 10 mM (in DMSO)

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CAS Number

118-93-4

Target

CYP19A1

Related Pathways

Others

Purity

0.9992

Bioactivity

2'-Hydroxyacetophenone (o-Hydroxyacetophenone) is a phenolic compound used in the synthesis of potential anti-myobacterial and anticancer agents.

Smiles

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

Molecular Formula

C8H8O2

Molecular Weight

136.15

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

2'-Hydroxyacetophenone

2-acetylphenol is a monohydroxyacetophenone that is acetophenone in which one of the hydrogens ortho to the acetyl group has been replaced by a hydroxy group. It has a role as a flavouring agent. It is a monohydroxyacetophenone and a member of phenols.

CAS Number	118-93-4
PubChem CID	8375
IUPAC Name	1-(2-hydroxyphenyl)ethanone
Molecular Formula	C8H8O2
Molecular Weight	136.15
XLogP	1.9
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	131

SMILES

CC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3

InChIKey

JECYUBVRTQDVAT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 118-93-4

CID: 8375

Formula: C8H8O2

MW: 136.15

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	136.15
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	136.052429494
Monoisotopic Mass	136.052429494
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	131
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
T7084	2-Bromo-4'-hydroxyacetophenone
T20389-01	3-Hydroxyacetophenone
T3750-01	4-Hydroxyacetophenone
TN10084-01	2,6-Dimethoxy-4-hydroxyacetophenone
T10143-01	4-Hydroxyacetophenone oxime
T83367-01	3,5-Diprenyl-4-hydroxyacetophenone
TN9304-01	2,2,2-Trifluoroacetamide
T37709	2,2,2-Trichloroethanol
T125691-01	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl bromide
T9894-01	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate

Alternative Products

Catalog	Name
sc-230397	2-Hydroxyacetophenone
GTR19159999-01	2'-Hydroxyacetophenone
508005	2‐HYDROXYACETOPHENONE
TRC-H739970-5G	2’-Hydroxyacetophenone
S9375-25mg	2´-Hydroxyacetophenone
H9025-65	2’-Hydroxyacetophenone Oxime
H9025-60	2-Hydroxyacetophenone-d7

2'-Hydroxyacetophenone

Chemical Information

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