CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless liquid; [HSDB] |
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Color/Form | COLORLESS LIQUID |
Boiling Point | 148 °C @ 760 MM HG |
Flash Point | 54 °C |
Solubility | SOL IN ALCOHOL; ETHER; ACETONE |
Density | 0.8263 @ 20 °C/4 °C |
Vapor Density | 3.52 (AIR= 1) |
Vapor Pressure | 1.92 [mmHg] |
Autoignition Temperature | 590 °F (310 °C) |
Refractive Index | INDEX OF REFRACTION: 1.4182 @ 20 °C/D; SADTLER REFERENCE NUMBER: 10607 (IR, PRISM) |
Kovats Retention Index | 822 826 827 836.2 837.5 820 820 822 824 837 824 818 824 824 837 813 818 808.4 837 |
Other Experimental Properties | Liquid Molar Volume = 0.1235 cu m/kmol |
Chemical Classes | Solvents -> Alcohols (<C12) |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H302: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. P242:Use only non-sparking tools. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
COMPUTED DESCRIPTORS
Molecular Weight | 102.17 g/mol |
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XLogP3 | 1.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 3 |
Exact Mass | 102.104465066 g/mol |
Monoisotopic Mass | 102.104465066 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 35.2 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-Methyl-1-pentanol is a natural product found in Nepeta nepetella and Patrinia villosa with data available.