3-Buten-1-ol
ALDRICH/496839 - 96%
Synonym: Allylcarbinol
CAS Number: 627-27-0
Empirical Formula (Hill Notation): C4H8O
Molecular Weight: 72.11
EC Number: 210-991-3
MDL Number: MFCD00002959
Linear Formula: CH2=CHCH2CH2OH
Product Type: Chemical
assay | 96% |
bp | 112-114 °C (lit.) |
density | 0.838 g/mL at 25 °C (lit.) |
InChI | 1S/C4H8O/c1-2-3-4-5/h2,5H |
InChI key | ZSPTYLOMNJNZNG-UHFFFAOYSA |
refractive index | n |
SMILES string | OCCC=C |
Application: | Employed in a study of the Mn-catalyzed hydrohydrazination of olefins. Also used in a study of the conversion of propargylic acetates to ethers cataylzed by ferric chloride. |
General description: | 3-Buten-1-ol is a homoallyl alcohol that can be prepared by the dehydration of 1,4-butanediol using cerium catalyst. The intramolecular hydrogen bonding of 3-buten-1-ol has been studied using FT-IR and 1H NMR spectroscopic data. Its microwave spectrum has been recorded and analyzed. The alkylation reaction of 3-buten-1-ol using titanium-organoaluminum system has been studied. Its gas-phase enthalpy of formation has been reported to be -147.3 ± 1.8kJ mol-1. |
Packaging: | 1 kg in glass bottle |
Packaging: | 25, 100 g in glass bottle |
Symbol | GHS02,GHS07 |
Signal word | Warning |
Hazard statements | H226 - H315 - H319 - H335 |
Precautionary statements | P210 - P233 - P240 - P241 - P303 + P361 + P353 - P305 + P351 + P338 |
Hazard Codes | Xi |
Risk Statements | 10-36/37/38 |
Safety Statements | 16-26-36 |
RIDADR | UN 1987C 3 / PGIII |
WGK Germany | WGK 3 |
Flash Point(F) | 91.4 °F - closed cup |
Flash Point(C) | 33 °C - closed cup |
Purity | 96% |
bp | 112-114 °C (lit.) |
Density | 0.838 g/mL at 25 °C (lit.) |
Refractive Index | n |
UNSPSC | 12352100 |