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3′,4′-Dihydroxyacetophenone

3′,4′-Dihydroxyacetophenone structure

CAS No:
1197-09-7
Formula:
C8H8O3
Chemical Name:
3′,4′-Dihydroxyacetophenone
Synonyms:
Ethanone,1-(3,4-dihydroxyphenyl)-;Acetophenone,3′,4′-dihydroxy-;1-(3,4-Dihydroxyphenyl)ethanone;4-Acetopyrocatechol;Acetopyrocatechol;4-Acetyl-1,2-benzenediol;3′,4′-Dihydroxyacetophenone;4-Acetylpyrocatechol;Qingxintong;4-Acetylcatechol;1-(3,4-Dihydroxyphenyl)ethan-1-one;Pungenol;4-Acetyl-1,2-dihydroxybenzene
Categories:
Natural Products > Phenols

Description

3',4'-Dihydroxyacetophenone (3,4-DHAP), isolated from Picea Schrenkiana Needles exhibits a strong suppressive action against tyrosinase activity, with an IC50 of 10 μM. 3',4'-Dihydroxyacetophenone (3,4-DHAP) is a vasoactive agent and antioxidant[1][2].

Solid

3,4-dihydroxyacetophenone is a member of acetophenones. It has a role as a metabolite.

3′,4′-Dihydroxyacetophenone Basic Attributes

Molecular Weight：

152.15

Exact Mass：

152.15

UNII：

07OQ35LVBK

DSSTox ID：

DTXSID30152546

HScode：

2914501900

Characteristics

PSA：

57.5

XLogP3：

1.5

Appearance：

Solid

Density：

1.291±0.06 g/cm3(Predicted)

Melting Point：

118-119 °C

Boiling Point：

127-133 °C @ Press: 11 Torr

Flash Point：

193.2±20.2 °C

Refractive Index：

1.595

Water Solubility：

6.943e+004 mg/L @ 25 °C (est)

Vapor Pressure：

4.5E-06mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

hazard class code：

36/37/38

safety instructions：

26-36-36/37

RTECS Number：

KM5775200

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Agents used for the treatment or prevention of cardiac arrhythmias. They may affect the polarization-repolarization phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibers. Anti-arrhythmia agents are often classed into four main groups according to their mechanism of action: sodium channel blockade, beta-adrenergic blockade, repolarization prolongation, or calcium channel blockade. (See all compounds classified as Anti-Arrhythmia Agents.)|Drugs or agents which antagonize or impair any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system. (See all compounds classified as Platelet Aggregation Inhibitors.)

MeSH Entry Terms：

3,4-dihydroxyacetophenone

Computed Properties

Molecular Weight:152.15
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:152.047344113
Monoisotopic Mass:152.047344113
Topological Polar Surface Area:57.5
Heavy Atom Count:11
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3′,4′-Dihydroxyacetophenone

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Recommended Suppliers
Latest News
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3′,4′-Dihydroxyacetophenone

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