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Guaiacylacetone

Guaiacylacetone structure

CAS No:
2503-46-0
Formula:
C10H12O3
Chemical Name:
Guaiacylacetone
Synonyms:
2-Propanone,1-(4-hydroxy-3-methoxyphenyl)-;2-Propanone,(4-hydroxy-3-methoxyphenyl)-;1-(4-Hydroxy-3-methoxyphenyl)-2-propanone;Guaiacylacetone;Vanillyl methyl ketone;(4-Hydroxy-3-methoxyphenyl)acetone;Methyl vanillyl ketone;2-Propiovanillone;NSC 16690;4-Hydroxy-3-methoxyphenyl-2-propanone;280142-99-6
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

Yellow Liquid

Guaiacylacetone Basic Attributes

Molecular Weight：

180.2

Exact Mass：

180.20

EC Number：

219-704-6

UNII：

0626DKI6FE

NSC Number：

16690

DSSTox ID：

DTXSID1075060

HScode：

29145090

Characteristics

PSA：

46.5

XLogP3：

0.41

Density：

1.1±0.1 g/cm3

Boiling Point：

115 °C @ Press: 0.15 Torr

Flash Point：

>230 °F

Refractive Index：

1.532

Water Solubility：

soluble in alcohol and water, 1.101e+004 mg/L @ 25°C (est.).

Vapor Pressure：

0.000449mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

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 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1-(4-hydroxy-3-methoxyphenyl)-2-propanone

Guaiacylacetone Use and Manufacturing

Volatile aromatic compound released from hard woods.It is often found in wine that has been aged in wood barrels contributing to the wine’s flavor profile.It is also released during combustion, giving flavor to smoked meats.

Computed Properties

Molecular Weight:180.20
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:180.078644241
Monoisotopic Mass:180.078644241
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Guaiacylacetone

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of Chemical Pesticides,Food Additives,Agrochemicals,Active Pharm Ingredients,Flavors and Fragrances,Chemical Catalyst,Chemical Materials,Chem&Pharm Intermediates,Organic Intermediates,Feed Additive

C10H12O3 99% Dideu

CAS No.: 2503-46-0

Grade: Industrial Grade

Content: 99%

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Guide of Guaiacylacetone

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Guaiacylacetone

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