3691-12-1

Q: What is the CAS number for α-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene?

The CAS number of α-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene is 3691-12-1.

Q: What is α-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene (3691-12-1) used for?

α-Guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene is a carbobicyclic compound and sesquiterpene that is 1,2,3,4,5,6,7,8-octahydroazulene which is substituted by methyl groups at positions 1 and 4 and by a (prop-1-en-2-yl) group at position 7 (the 1S,4S,7R enantiomer).InChI:InChI=1/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3

Product Nameα-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene
Molecular FormulaC15H24
Molecular Weight204.356
Purity99%

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Product Details

Quick Details

CasNo： 3691-12-1
Molecular Formula： C15H24
Purity： 99%

Top Quality α-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene 3691-12-1 Hot Sell In Stock

Molecular Formula:C₁₅H₂₄
Molecular Weight:204.356
Vapor Pressure:0.0062mmHg at 25°C
Boiling Point:281.1°Cat760mmHg
Flash Point:111.2°C
PSA：0.00000
Density:0.89g/cm³
LogP:4.72520

α-guaiene,guaia-1(5),11-diene,[1S-(1a,4a,7a)]-1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-azulene(Cas 3691-12-1) Usage

Definition

ChEBI: A carbobicyclic compound and sesquiterpene that is 1,2,3,4,5,6,7,8-octahydroazulene which is substituted by methyl groups at positions 1 and 4 and by a (prop-1-en-2-yl group at position 7 (the 1S,4S,7R ena tiomer).

InChI:InChI=1/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3

3691-12-1 Relevant articles

Revisiting the Chemistry of Guaiacwood Oil: Identification and Formation Pathways of 5,11- and 10,11-Epoxyguaianes

Tissandié, Lo?c,Gaysinski, Marc,Brévard, Hugues,Meierhenrich, Uwe J.,Filippi, Jean-Jacques

, p. 526 - 537 (2017/03/09)

Guaiacwood oil from Bulnesia sarmientoi ...

Synthesis of guaia-4(5)-en-11-ol, guaia-5(6)-en-11-ol, aciphyllene, 1- epi -melicodenones C and E, and other guaiane-type sesquiterpenoids via the diastereoselective epoxidation of guaiol

Huang, An-Cheng,Sumby, Christopher J.,Tiekink, Edward R.T.,Taylor, Dennis K.

, p. 2522 - 2536 (2015/01/09)

The diastereomeric ratio of epoxidation ...

Effective analysis of rotundone at below-threshold levels in red and white wines using solid-phase microextraction gas chromatography/tandem mass spectrometry

Mattivi,Caputi,Carlin,Lanza,Minozzi,Nanni,Valenti,Vrhovsek

experimental part, p. 483 - 488 (2012/02/02)

Rotundone is an oxygenated sesquiterpene...

Doubly deuterium-labeled patchouli alcohol from cyclization of singly labeled [2-2H 1]farnesyl diphosphate catalyzed by recombinant patchoulol synthase

Faraldos, Juan A.,Wu, Shuiqin,Chappell, Joe,Coates, Robert M.

experimental part, p. 2998 - 3008 (2010/05/01)

Incubations of isotopically pure [2-2H1]...

3691-12-1 Process route

: 489-86-1
guaiol

: 3691-12-1,53863-54-0
(1S,4S,7R)-7-Isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-octahydro-azulene

Conditions

Conditions	Yield
With pyridine; thionyl chloride;
Multi-step reaction with 2 steps 1: pyridine 2: 230 °C With pyridine;
Multi-step reaction with 2 steps 1: dmap / 6 h / 150 °C / Inert atmosphere 2: 6 h / 220 °C / Inert atmosphere With dmap;

: 13744-53-1
2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]-propan-2-yl benzoate

: 3691-12-1,53863-54-0
(1S,4S,7R)-7-Isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-octahydro-azulene

Conditions

Conditions	Yield
at 230 ℃; under 110 Torr;
at 230 ℃;

3691-12-1 Upstream products

489-86-1
guaiol
13744-53-1
2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]-propan-2-yl benzoate
134-28-1
2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]-propan-2-yl acetate
22451-73-6
2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydro-5-azulenyl)-2-propanol

3691-12-1 Downstream products

18374-76-0
(3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one
1353713-25-3
(1R,3S,5R,8S)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulen-1-ol
1353713-26-4
(1S,3S,5R,8S)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulen-1-ol
97094-19-4
(4S,4aS,6R,8aR)-4a-hydroxy-4,8a-dimethyl-6-(prop-1-en-2-yl)octahydronaphthalen-1(2H)-one-methane