1191-16-8
Product Name:
Prenyl acetate
Formula:
C7H12O2
Synonyms:
3,3-dimethyl allyl acetate;3-methyl-2-buten-1-ol acetate;3-methyl-2-buten-1-yl acetate;3-methyl-2-butenyl acetate;Isopent-2-enyl acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Dry Powder, Liquid, Other Solid; Liquid |
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Boiling Point | 151.00 to 152.00 °C. @ 752.00 mm Hg |
Solubility | Practically insoluble to insoluble in water |
Density | 0.911-0.922 |
LogP | 1.650 |
Refractive Index | 1.424-1.428 |
Kovats Retention Index | 902 905 900 902 909 900 895 902 902 901 902 904 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 |
GHS Hazard Statements |
H226:Flammable liquids H303:Acute toxicity,oral |
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. P280:Wear protective gloves/protective clothing/eye protection/face protection. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 128.17 g/mol |
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XLogP3 | 1.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 128.083729621 g/mol |
Monoisotopic Mass | 128.083729621 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 121 |
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
Isopentenyl acetate is a carboxylic ester.