4-Methyl-3-penten-1-ol
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4-Methyl-3-penten-1-ol
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CAS No:
763-89-3
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Formula:
C6H12O
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Chemical Name:
4-Methyl-3-penten-1-ol
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Synonyms:
3-Penten-1-ol,4-methyl-;4-Methyl-3-penten-1-ol;4-Methyl-3-pentenol;4-Methyl-3-pentene-1-ol;1-Hydroxy-4-methylpent-3-ene;2-Methyl-2-penten-5-ol;Homoprenyl alcohol
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CAS No:
Description
4-methylpent-3-en-1-ol is a homoallylic alcohol that is 2-methylpent-2-ene in which a hydrogen of the methyl group at position 5 has been replaced by a hydroxy group. It has a role as a plant metabolite. It is a homoallylic alcohol and a primary alcohol.
Characteristics
20.23000
1.33500
0.8615 g/cm3 @ Temp: 20 °C
22.55°C (estimate)
157-158 °C @ Press: 771 Torr
146 °F
n20/D 1.445(lit.)
Safety Information
3
Xn
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:100.16
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:100.088815002
Monoisotopic Mass:100.088815002
Topological Polar Surface Area:20.2
Heavy Atom Count:7
Complexity:60.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes