CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid; [HSDB] |
|---|---|
| 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 |
|---|---|
| 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 |
|---|---|
| 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.