136816
2-Methyl-3-buten-2-ol
98%
Synonym(s):
1,1-Dimethylallyl alcohol, 3-Hydroxy-3-methyl-1-butene
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About This Item
Recommended Products
vapor pressure
51 mmHg ( 25 °C)
Quality Level
Assay
98%
form
liquid
refractive index
n20/D 1.416 (lit.)
bp
98-99 °C (lit.)
density
0.824 g/mL at 25 °C (lit.)
storage temp.
2-8°C
SMILES string
CC(C)(O)C=C
InChI
1S/C5H10O/c1-4-5(2,3)6/h4,6H,1H2,2-3H3
InChI key
HNVRRHSXBLFLIG-UHFFFAOYSA-N
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General description
2-Methyl-3-buten-2-ol is a biogenic volatile organic compound emitted by pine trees and a potential precursor of atmospheric secondary organic aerosol in forested regions. It is an important component of the pheromone of the bark beetle Ips typographus.
Application
2-Methyl-3-buten-2-ol was used to study the kinetics of the gas-phase reaction of OH radicals with 3-methyl-2-butenal.
Reported to be an important component of the pheromone of the bark beetle Ips typographus.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2
Storage Class Code
3 - Flammable liquids
WGK
WGK 1
Flash Point(F)
51.8 °F - closed cup
Flash Point(C)
11 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Chemical and Engineering News, 57, 10-10 (1979)
Physical chemistry chemical physics : PCCP, 7(11), 2298-2304 (2005-06-07)
Kinetics and products of the gas-phase reaction of OH radicals with 3-methyl-2-butenal [(CH3)2C=CHCHO] have been investigated at room temperature and atmospheric pressure of air. Using a relative rate method with methacrolein as the reference compound, a rate constant for the
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 48 Suppl 3, S97-100 (2010-02-10)
A toxicologic and dermatologic review of 2-methyl-3-buten-2-ol when used as a fragrance ingredient is presented.
Environmental science & technology, 43(13), 4647-4652 (2009-08-14)
2-Methyl-3-buten-2-ol (MBO) is an important biogenic hydrocarbon emitted in large quantities by pine forests. Atmospheric photooxidation of MBO is known to lead to oxygenated compounds, such as glycolaldehyde, which is the precursor to glyoxal. Recent studies have shown that the
Physical chemistry chemical physics : PCCP, 8(4), 456-463 (2006-02-17)
Quantum mechanical calculations were used to determine the structure and energetics of peroxy radicals (P1 and P2) and alkoxy radicals (A1-A3) formed in the atmospheric degradation of 2-methyl-3-buten-2-ol. At the level of theory employed (B3LYP/6-31G(d,p)) low energy conformers were identified
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