cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol
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cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol
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CAS No:
5989-33-3
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Formula:
C10H18O2
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Chemical Name:
cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol
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Synonyms:
cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol;(Z)-linalooloxide,(Z)-2-methyl-2-vinyl-5-(2-hydroxy-2-proply)tetrahydrfuran,cis-linaloolfuranoxide;5-ethenyltetrahydro-.alpha.,.alpha.-5-trimethyl-, cis-2-Furanmethanol;cis-5-Ethenyltetrahydro-.alpha.,.alpha.-5-trimethyl-2-furanmethanol;cis-Linalool oxide;Linalool oxide B;Linalool oxide I;rel-1-[[(2R*,5S*)-5-Methyl-5-vinyltetrahydrofuran]-2-yl]-1-methylethanol
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CAS No:
Description
cis-Α,Α-5-Trimethyl-5-vinyltetrahydrofuran-2-methanol is a colorless to light yellow liquid at room temperature and pressure, poorly soluble in water but readily soluble in common organic solvents. Its structure contains a terminal double bond and a tertiary alcohol structure with high reactivity.
ChEBI: (2R,5S)-linalyl oxide is a monoterpenoid that is 2-(2-hydroxypropan-2-yl)oxolane carying additional methyl and vinyl substituents both located at position 5 (the 2R,5S-diastereomer). It is a member of oxolanes, a monoterpenoid, a tertiary alcohol and an olefinic compound.
cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol Basic Attributes
170.25
170.25
227-814-0
TSCA listed
Colourless to Yellow
Characteristics
29.46000
1.88100
1.023±0.06 g/cm3(Predicted)
188 °C
75.4ºC
1.519
at 100.00 %. earthy floral sweet woody
14.57±0.29(Predicted)
Safety Information
P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501|Aggregated GHS information provided by 113 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol Use and Manufacturing
cis-Linalool Oxide is a derivative of Linalool (L465950), which is a terpene alcohol common in various flowers and spice plants.┬аcis-Linalool Oxide has been employed to assess the effect of vine on the glycosylated┬аflavour┬аprocurers in grapes.
2-Furanmethanol, 5-ethenyltetrahydro-.alpha.,.alpha.,5-trimethyl-, (2R,5S)-rel-: ACTIVE
Computed Properties
Molecular Weight:170.25
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:170.130679813
Monoisotopic Mass:170.130679813
Topological Polar Surface Area:29.5
Heavy Atom Count:12
Complexity:186
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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cis-alpha,alpha,5-trimethyl-5-vinyltetrahydrofuran-2-methanol
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