2349-07-7
Product Name:
Hexyl isobutyrate
Formula:
C10H20O2
Synonyms:
Hexyl-2-methylpropionate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid, Other Solid |
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Boiling Point | 198.00 to 199.00 °C. @ 760.00 mm Hg |
Solubility | very slightly |
Kovats Retention Index | 1132 1132 1131 1134 1175 1137 1137 1137 1138 1128 1117 1117 1126 1127 1092 1127 1117 1130 1135 1092 1135 1135 1134 1135 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 172.26 g/mol |
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XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 7 |
Exact Mass | 172.146329876 g/mol |
Monoisotopic Mass | 172.146329876 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 119 |
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
Hexyl 2-methylpropanoate is a carboxylic ester.