4516-90-9

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4516-90-9 Structure

Identification	Back Directory
[Name] 2-METHYL-3-BUTEN-1-OL
[CAS] 4516-90-9
[Synonyms] 2-methyl-3-buten-1-o 2-METHYL-3-BUTEN-1-OL 2-methyl-3-butene-1-ol 2-Methyl-but-3-en-1-ol 3-Buten-1-ol, 2-methyl- (R,S)-2-Methyl-but-3-en-1-ol
[Molecular Formula] C5H10O
[MDL Number] MFCD00009985
[MOL File] 4516-90-9.mol
[Molecular Weight] 86.13

Chemical Properties	Back Directory
[Appearance] colourless liquid
[Melting point ] 33.52°C
[Boiling point ] 120-121 °C756 mm Hg(lit.)
[density ] 0.835 g/mL at 25 °C(lit.)
[refractive index ] n20/D 1.427(lit.)
[Fp ] 92 °F
[form ] Liquid
[pka] 14.81±0.10(Predicted)
[color ] Clear colorless
[Stability:] Flammable. Incompatible with strong oxidizing agents, strong acids, acid chlorides, acid anhydrides.
[InChI] InChI=1S/C5H10O/c1-3-5(2)4-6/h3,5-6H,1,4H2,2H3
[InChIKey] NVGOATMUHKIQQG-UHFFFAOYSA-N
[SMILES] C(O)C(C)C=C
[LogP] 1.033 (est)
[EPA Substance Registry System] 3-Buten-1-ol, 2-methyl- (4516-90-9)

Hazard Information	Back Directory
[Chemical Properties] colourless liquid
[Uses] 2-Methyl-3-buten-1-ol is a useful research chemical used as a reactant in the preparation of macrolides by ring closing metathesis.
[Definition] ChEBI: 2-Methyl-3-buten-1-ol is a primary alcohol.
[General Description] Secondary organic aerosol (SOA) formation from 2-methyl-3-buten-2-ol (MBO) photooxidation was investigated.

Spectrum Detail	Back Directory
[Spectrum Detail] 2-METHYL-3-BUTEN-1-OL(4516-90-9)MS 2-METHYL-3-BUTEN-1-OL(4516-90-9)¹HNMR 2-METHYL-3-BUTEN-1-OL(4516-90-9)¹³CNMR 2-METHYL-3-BUTEN-1-OL(4516-90-9)IR 2-METHYL-3-BUTEN-1-OL(4516-90-9)Raman

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