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106-27-4

106-27-4 structural image
Product Name: Isoamyl butyrate
Formula: C9H18O2
Synonyms: Butyric acid (3-methylbutyl ester);Isoamyl butyrate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Boiling Point 179.00 °C. @ 760.00 mm Hg
Melting Point -73.2 °C
Solubility 118 mg/L @ 25 °C (exp)
Density 0.861 - 0.866
LogP 3.250
Refractive Index 1.409 - 1.414
Kovats Retention Index 1086 1041 1041 1039 1039.4 1002 1041 1044 1039 1031 1029 1029 1039 1046 1039 1042 1029 1040.3 1042 1042 1038 1039 1042 1040

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02
GHS Hazard Statements H226:Flammable liquids
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P242:Use only non-sparking tools.
P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 158.24 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 158.130679813 g/mol
Monoisotopic Mass 158.130679813 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 108
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Isoamyl butyrate is the butanoate ester of isoamylol. It has a role as a metabolite. It is functionally related to an isoamylol.

RELATED SUPPLIERS

HJ AROCHEM

1Y
product:106-27-4 99%

Premier Solvents Pvt. Ltd. (Vijay Ajmera Group)

1Y
product:Isoamyl n-butyrate 99%

HRV Global Life Sciences

1Y
product:Isoamyl n-butyrate 106-27-4 99%

Arpan Aromatics

1Y
product:106-27-4 Isoamyl n-butyrate 98%
All suppliers(4)