1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-

Base Information

Chemical Name:1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-
CAS No.:6750-60-3
Molecular Formula:C15H24O
Molecular Weight:220.355
Hs Code.:
DSSTox Substance ID:DTXSID00881210
Wikidata:Q105000256
Wikipedia:Spathulenol
Mol file:6750-60-3.mol

Synonyms:1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-;6750-60-3;DTXSID00881210;(1aR,4aR,7S,7aR,7bR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol;NS00096332

Suppliers and Price of 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

ChemScene
Spathulenol
1mg
$ 343.00

ChemScene
Spathulenol
5mg
$ 1029.00

Biosynth Carbosynth
Spathulenol
25 mg
$ 1750.00

Biosynth Carbosynth
Spathulenol
10 mg
$ 850.00

Biosynth Carbosynth
Spathulenol
5 mg
$ 550.00

Biosynth Carbosynth
Spathulenol
1 mg
$ 200.00

Biosynth Carbosynth
Spathulenol
2 mg
$ 300.00

Arctom
Spathulenol ≥98%
5mg
$ 293.00

AK Scientific
Spathulenol
5mg
$ 792.00

Total 53 raw suppliers

Chemical Property of 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-

Chemical Property:

Vapor Pressure:0.000141mmHg at 25°C
Boiling Point:297°C at 760 mmHg
PKA:15.10±0.40(Predicted)
Flash Point:123.9°C
PSA：20.23000
Density:1.02g/cm³
LogP:3.38580
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:220.182715385
Heavy Atom Count:16
Complexity:343

Purity/Quality:

98% ^*data from raw suppliers

Spathulenol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C
Isomeric SMILES:C[C@@]1(CC[C@@H]2[C@H]1[C@H]3[C@H](C3(C)C)CCC2=C)O
Description Spathulenol?is a tricyclic?sesquiterpene?alcohol which has a basic skeleton similar to the?azulenes,it occurs in?oregano?among other plants.
Uses Eucalyptol is an organic alcohol compound, mainly used for content determination and experimental research, not for other purposes.

Technology Process of 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-

There total 15 articles about 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 79.0%

: 99147-42-9
(+)-11β-hydroxy-apoaromadendrone

: 19493-09-5
Methylenetriphenylphosphorane

: 6750-60-3
spathulenol

Guidance literature:: DOI:10.1016/S0040-4039(00)94792-0

Reference yield: 57.0%

: 41437-00-7,67650-49-1,67650-90-2,79951-53-4,100762-45-6,100762-46-7,100762-48-9,100762-49-0,133005-43-3,24703-35-3
(+)-bicyclogermacrene

: 6750-60-3
spathulenol

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In chloroform-d1; chloroform; at 25 ℃; for 0.25h; Inert atmosphere;
DOI:10.1002/chem.201403082

Reference yield:

: 6790-66-5,14682-45-2,14917-87-4,95977-69-8,97275-30-4,97950-12-4,99147-41-8
(-)-apoaromadendrone

: 6750-60-3
spathulenol

Guidance literature:: Multi-step reaction with 2 steps

1: 36 percent / NaIO₄, RuO₂*xH₂O / CCl₄; acetonitrile; H₂O / 48 h / 50 °C

2: 1) Mg, I₂, 2) conc. H₂SO₄ / 1) ether, reflux, 2) THF, rt, 2 h

With ruthenium(IV) oxide; sodium periodate; sulfuric acid; iodine; magnesium; In tetrachloromethane; water; acetonitrile;
DOI:10.1016/S0040-4020(01)88765-2