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556-82-1

556-82-1 structural image
Product Name: 3-Methyl-2-buten-1-ol
Formula: C5H10O
Synonyms: 3,3-Dimethylallyl alcohol;Prenol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless liquid with an alcoholic odor; [OECD SIDS: IUCLID Data Set]
Boiling Point 138.00 to 174.00 °C. @ 760.00 mm Hg
Melting Point -59.3 °C
Flash Point 50 °C c.c.
Solubility Solubility in water, g/100ml at 20 °C: 17 (good)
Density 0.85 g/cm³
Vapor Density Relative vapor density (air = 1): 3.0
Vapor Pressure 1.05 [mmHg]
LogP 0.91
Autoignition Temperature 305 °C
Viscosity 3.5 mm²/s at 25 °C
Refractive Index 1.438-1.448
Kovats Retention Index 762 798 756 760.3 749 752 744.5 743 751 752 752 752 753
Chemical Classes Other Classes -> Alcohols and Polyols, Other

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H314:Skin corrosion/irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
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 86.13 g/mol
XLogP3 1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 86.073164938 g/mol
Monoisotopic Mass 86.073164938 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 51
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

Prenol is an alkenyl alcohol and a member of prenols.