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Piperonyl isobutyrate

Piperonyl isobutyrate structure

CAS No:
5461-08-5
Formula:
C12H14O4
Chemical Name:
Piperonyl isobutyrate
Synonyms:
Propanoic acid,2-methyl-,1,3-benzodioxol-5-ylmethyl ester;Isobutyric acid,piperonyl ester;Piperonyl isobutyrate;NSC 23947;1,3-Benzodioxol-5-ylmethyl 2-methylpropanoate

Description

Piperonyl isobutyrate has a very sweet but mild, fruity and berry-like odor with some jam-like qualities. It has an intense, sweet, plum-like flavor.

colourless oily liquid with a mild, fruity, berry-like odour

Piperonyl isobutyrate is a member of benzodioxoles.

Piperonyl isobutyrate Basic Attributes

Molecular Weight：

222.23700

Exact Mass：

222.24

EC Number：

226-745-3

UNII：

Y8HBR1ACYA

NSC Number：

23947

DSSTox ID：

DTXSID8063917

HScode：

2932999099

Characteristics

PSA：

44.76000

XLogP3：

2.11450

Appearance：

colourless oily liquid with a mild, fruity, berry-like odour

Density：

1.154 g/mL at 25 °C(lit.)

Boiling Point：

91-92 °C0.005 mm Hg(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.511(lit.)

Water Solubility：

insoluble in water; soluble in organic solvents, oils

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Precautionary statement(s)：

P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 1398 companies from 3 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

1,3-benzodioxole-5-methanol isobutyrate

Piperonyl isobutyrate Use and Manufacturing

Uses

Piperonyl Isobutyrate is a synthetic flavoring agent that is a mod- erately stable, colorless to light yellow liquid of fruity odor. it should be stored in glass or resin-lined containers. it is used in flavors for cherry, berry, and peach aroma with applications in beverages, candy, and baked goods at 1–4 ppm.

Manufacturing Info：

Propanoic acid, 2-methyl-, 1,3-benzodioxol-5-ylmethyl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:222.24
XLogP3:2.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:44.8
Heavy Atom Count:16
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Learn More Other Chemicals

2-((2-cyanoethyl)(phenyl)amino)ethyl isobutyrate

156814-31-2
3a,4,5,6,7,7a-Hexahydro-1H-4,7-methanoinden-5-yl isobutyrate

67634-20-2
Thymyl isobutyrate

5451-67-2
Chromomycinone,6-(4-O-α-olivomosyl-β-olioside) 2-(O-α-olivomycosyl-(1→3)-O-β-olivosyl-(1→3)-β-olivoside),acetate isobutyrate Formula

6992-70-7
(-)-Bornyl isobutyrate Formula

85586-66-9
Carbanilic acid, o-methoxy-, piperonyl ester (7CI, 8CI) Formula

6860-92-0
Isobornyl isobutyrate Structure

85586-67-0
Propyl isobutyrate Structure

644-49-5
What is Neryl isobutyrate

2345-24-6
What is Piperonyl chloride

20850-43-5

Hot Searches: 3-methylbutanal; natriumtripolyphosphat; ivorit; methanol sds; potassium sulphate formula; dimethyl terephthalate

Guide of Piperonyl isobutyrate

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Piperonyl isobutyrate

SDS

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