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3-COUMARANONE

3-COUMARANONE structure

CAS No:
7169-34-8
Formula:
C8H6O2
Chemical Name:
3-COUMARANONE
Synonyms:
COUMARANONE;3-COUMARANONE;3-Oxocoumaran;Coumaran-3-one;BENZOFURAN-3-ONE;3(2H)-BENZOFURANONE;BENZOFURAN-3(2H)-ONE;(2H)-Benzofuran-3-one;1-Benzofuran-3(2H)-one;Benzo[b]furan-3(2H)-one
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

white to light yellow crystal powde

3-COUMARANONE Basic Attributes

Molecular Weight：

134.13

Exact Mass：

134.036774

NSC Number：

512726

DSSTox ID：

DTXSID20221917

HScode：

2932999099

Characteristics

PSA：

26.3

XLogP3：

1.5

Appearance：

white to light yellow crystal powde

Density：

1.3±0.1 g/cm3

Melting Point：

101-103 °C

Boiling Point：

249.643ºC at 760 mmHg

Flash Point：

118.9±15.3 °C

Refractive Index：

1.585

Water Solubility：

Slightly miscible with water.

Safety Information

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S22-S24/25-S36/37/39-S26

Marks：

Xi,Xn

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 4 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3-coumaranone

Computed Properties

Molecular Weight:134.13
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Exact Mass:134.036779430
Monoisotopic Mass:134.036779430
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:153
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Magnesium sulfate heptahydrate

Phenol

Tetrahydrofuran

Sodium hydroxide

Potassium carbonate

Sodium acetate trihydrate

Acetic acid

Acetone

Dimethylformamide

Hydrochloric acid

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2H-Benzofuran-3-one

CAS No.: 7169-34-8

Content: 99.00%

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Greenbo Biochem Contact Supplier

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3-COUMARANONE 99% high purity certified Professional producer Greenbo

CAS No.: 7169-34-8

Grade: Food Grade

Content: 99%

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Guide of 3-COUMARANONE

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Material
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3-COUMARANONE

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