1-Butanol

1-Butanol
Skeletal formula of n-butanol
Skeletal formula of n-butanol
Spacefill model of n-butanol
Spacefill model of n-butanol
Skeletal formula of n-butanol with all explicit hydrogens added
Skeletal formula of n-butanol with all explicit hydrogens added
Names
Preferred IUPAC name
Butan-1-ol
Other names
n-Butanol
n-Butyl alcohol
n-Butyl hydroxide
n-Propylcarbinol
n-Propylmethanol
1-Hydroxybutane
Methylolpropane
Identifiers
3D model (JSmol)
Abbreviations BuOH
n-BuOH
nBuOH
nBuOH
969148
ChEBI
ChEMBL
ChemSpider
DrugBank
ECHA InfoCard 100.000.683
EC Number
  • 200-751-6
25753
KEGG
MeSH 1-Butanol
RTECS number
  • EO1400000
UNII
UN number 1120
  • InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3 checkY
    Key: LRHPLDYGYMQRHN-UHFFFAOYSA-N checkY
  • InChI=1/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
  • OCCCC
Properties
C4H10O
Molar mass 74.123 g·mol−1
Appearance Colourless, refractive liquid
Odor banana-like, harsh, alcoholic and sweet
Density 0.81 g/cm3
Melting point −89.8 °C (−129.6 °F; 183.3 K)
Boiling point 117.7 °C (243.9 °F; 390.8 K)
73 g/L at 25 °C
Solubility very soluble in acetone
miscible with ethanol, ethyl ether
log P 0.839
Vapor pressure 0.58 kPa (20 °C) ILO International Chemical Safety Cards (ICSC)
Acidity (pKa) 16.10
−56.536·10−6 cm3/mol
1.3993 (20 °C)
Viscosity 2.573 mPa·s (at 25 °C)
1.66 D
Thermochemistry
225.7 J/(K·mol)
−328(4) kJ/mol
−2670(20) kJ/mol
Hazards
GHS labelling:
GHS02: FlammableGHS05: CorrosiveGHS07: Exclamation mark
H226, H302, H315, H318, H335, H336
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
NFPA 704 (fire diamond)
NFPA 704 four-colored diamond
1
3
0
Flash point 35 °C (95 °F; 308 K)
343 °C (649 °F; 616 K)
Explosive limits 1.45–11.25%
Lethal dose or concentration (LD, LC):
790 mg/kg (rat, oral)
3484 mg/kg (rabbit, oral)
790 mg/kg (rat, oral)
1700 mg/kg (dog, oral)
9221 ppm (mammal)
8000 ppm (rat, 4 h)
NIOSH (US health exposure limits):
PEL (Permissible)
TWA 100 ppm (300 mg/m3)
REL (Recommended)
C 50 ppm (150 mg/m3) [skin]
IDLH (Immediate danger)
1400 ppm
Safety data sheet (SDS) ICSC 0111
Related compounds
Related compounds
Butanethiol
n-Butylamine
Diethyl ether
Pentane
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
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Infobox references

1-Butanol, also known as butan-1-ol or n-butanol, is a primary alcohol with the chemical formula C4H10O, C4H9OH or CH3(CH2)3OH and a linear structure. Isomers of 1-butanol are isobutanol, butan-2-ol and tert-butanol. The unmodified term butanol usually refers to the straight chain isomer.

1-Butanol occurs naturally as a minor product of the ethanol fermentation of sugars and other saccharides and is present in many foods and drinks. It is also a permitted artificial flavorant in the United States, used in butter, cream, fruit, rum, whiskey, ice cream and ices, candy, baked goods, and cordials. It is also used in a wide range of consumer products.

The largest use of 1-butanol is as an industrial intermediate, particularly for the manufacture of butyl acetate (itself an artificial flavorant and industrial solvent). It is a petrochemical derived from propylene. Estimated production figures for 1997 are: United States 784,000 tonnes; Western Europe 575,000 tonnes; Japan 225,000 tonnes.