 Home > Encyclopedia > Isopropyl acetoacetate

Isopropyl acetoacetate

Isopropyl acetoacetate structure

CAS No:
542-08-5
Formula:
C7H12O3
Chemical Name:
Isopropyl acetoacetate
Synonyms:
Butanoic acid,3-oxo-,1-methylethyl ester;Acetoacetic acid,isopropyl ester;Isopropyl acetoacetate;Isopropyl 3-oxobutanoate;Isopropyl 3-oxobutyrate;3-Oxobutanoic acid 1-methylethyl ester;3-Oxobutanoic acid isopropyl ester
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Request for Quotation

Description

Colourless Liquid

Liquid

Isopropyl acetoacetate Basic Attributes

Molecular Weight：

144.17

Exact Mass：

144.17

BRN：

1757046

EC Number：

208-798-4

UNII：

38GTB2C6XC

DSSTox ID：

DTXSID7060253

HScode：

2918300090

Characteristics

PSA：

43.37000

XLogP3：

1.06

Appearance：

Liquid

Density：

0.9835 g/cm³ @ Temp: 25 °C

Melting Point：

-27.3 °C

Boiling Point：

186 °C

Flash Point：

73°C

Refractive Index：

1.414

Water Solubility：

Slightly miscible with water.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

safety instructions：

26-36-24/25

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 (71.88%): 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 95 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Isopropyl acetoacetate Use and Manufacturing

Uses

Isopropyl acetoacetate (IPAA) is used as intermediate for chemical synthesis. Product Data Sheet

Intermediates

Ink, toner, and colorant products

Production

25,000 - 100,000 lb

Manufacturing Info：

Printing ink manufacturing|Butanoic acid, 3-oxo-, 1-methylethyl ester: ACTIVE

Computed Properties

Molecular Weight:144.17
XLogP3:0.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:144.078644241
Monoisotopic Mass:144.078644241
Topological Polar Surface Area:43.4
Heavy Atom Count:10
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Isopropyl acetoacetate

Hangzhou KieRay Chem Co.,LTD Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of fine chemicals,pharmaceutical materials

Isopropyl acetoacetate

CAS No.: 542-08-5

Grade: industrial Grade

Content: 98%

Inquiry
Greenbo Biochem Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED Intermediates

Isopropyl acetoacetate 99% high purity certified Professional producer Greenbo

CAS No.: 542-08-5

Grade: Industrial Grade

Content: 99%

Inquiry
NANTONG REFORM PETRO-CHEMICAL CO.,LTD Contact Supplier

CN
4 YRS

Business licensed Certified factory

Manufactory Supplier of Flavors & Fragrances,Catalyst & Auxiliary,Intermediates,Dyes & Pigments,Inorganic Chemistry,petro chemicals,Surfactant,Food Additives,Water Treatment Chemicals

Isopropyl Acetoacetate

CAS No.: 542-08-5

Grade: Industrial Grade

Content: 99%

Inquiry