Guaiol structure, CAS 489-86-1

Guaiol

CAS Number489-86-1

Synonyms2-[(3S,5R,8S)-3,8-Dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol; (-)-GUAIOL; Guaiac alcohol; Champacol; Cuajol; Champaca camphor; Gualol; Guaiol; 2-[(3S,5R,8S)-3,8-Dimethyl-1,2,3,4,5,6,7,8-octahydro-5-azulenyl]-2-propanol; Champaeol; [3S-(3a,5a,8a)]-1,2,3,4,5,6,7,8-Octahydro-a,a,3,8-tetramethyl-5-azulenemethanol; 3,8-Dimethyl-5-(a-hydroxyisopropyl)-D9-octahydroazulene

Molecular FormulaC15H26O

Molecular Weight222.37

Purity≥99.0 (HPLC)%

Density1.0±0.1 g/cm3

Boiling Point288.0±0.0 °C at 760 mmHg

Melting Point91-93 °C

Flash Point

Appearancepowder

EINECS207-702-8

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9010792 Purity: ≥99.0 (HPLC)%
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Quality Control of [ 489-86-1 ] Purity: ≥99.0 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number489-86-1
Catalog No.2A-9010792
Chinese Name愈创醇
Synonyms2-[(3S,5R,8S)-3,8-Dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol; (-)-GUAIOL; Guaiac alcohol; Champacol; Cuajol; Champaca camphor; Gualol; Guaiol; 2-[(3S,5R,8S)-3,8-Dimethyl-1,2,3,4,5,6,7,8-octahydro-5-azulenyl]-2-propanol; Champaeol; [3S-(3a,5a,8a)]-1,2,3,4,5,6,7,8-Octahydro-a,a,3,8-tetramethyl-5-azulenemethanol; 3,8-Dimethyl-5-(a-hydroxyisopropyl)-D9-octahydroazulene
Molecular FormulaC15H26O
Molecular Weight222.37
Purity≥99.0 (HPLC)
Density1.0±0.1 g/cm3
Boiling Point288.0±0.0 °C at 760 mmHg
Melting Point91-93 °C
Appearancepowder
Storage Condition2-8℃, sealed, dry
ApplicationGuaiol is a sesquiterpene alcohol found in a variety of traditional Chinese medicines and has biological activities such as anti-proliferation, promotion of autophagy, anthelmintic and insecticidal pr
EINECS207-702-8
PubChem ID329753329
MDL NumberMFCD00043336
SMILESC[C@H]1CC[C@H](CC2=C1CC[C@@H]2C)C(C)(C)O
InChI1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h10-12,16H,5-9H2,1-4H3/t10-,11-,12+/m0/s1
InChI KeyTWVJWDMOZJXUID-SDDRHHMPSA-N
Beilstein/REAXYS2047993
NACRES CodeNA.24
UNSPSC85151701
Hazard SymbolsTransport
MSDSmsds/10792_1_489_86_1.pdf
BioactivityGuaiol is a sesquiterpene alcohol that has been found in several traditional Chinese medicinal plants and has antiproliferative, pro-autophagic, insect repellent, and insecticidal biological activities[1][2][3]. Related Catalog Research Areas >> Cancer Research Areas >> Infection Signaling Pathways >> Others >> Others References [1]. Yang, Q, et al. (−)-Guaiol regulates RAD51 stability via autophagy to induce cell apoptosis in non-small cell lung cancer Oncotarget. 2016 Sep 20;7(38):62585-62597. [2]. Ali, A., Tabanca, et al. Chemical composition and biological activity of four salvia essential oils and individual compounds against two species of mosquitoes J. Agric. Food Chem. 63(2), 447-456 (2015). [3]. Liu, T, et al. Guaiol - a naturally occurring insecticidal sesquiterpene Nat. Prod. Commun. 8(10), 1353-1354 (2013). Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 288.0±0.0 °C at 760 mmHg Melting Point 91-93ºC(lit.) Molecular Formula C15H26O Molecular Weight 222.37 Flash Point 113.6±15.6 °C Exact Mass 222.198364 PSA 20.23000 LogP 4.81 Vapour Pressure 0.0±1.3 mmHg at 25°C Index of Refraction 1.503 InChIKey TWVJWDMOZJXUID-SDDRHHMPSA-N SMILES CC1CCC(C(C)(C)O)CC2=C1CCC2C
Use ofGuaiol is a sesquiterpene alcohol that has been found in several traditional Chinese medicinal plants and has antiproliferative, pro-autophagic, insect repellent, and insecticidal biological activities[1][2][3]. Properties Name guaiol Synonym More Synonyms Guaiol Biological Activity Description Guaiol is a sesquiterpene alcohol that has been found in several traditional Chinese medicinal plants and has antiproliferative, pro-autophagic, insect repellent, and insecticidal biological activities[1][2][3]. Related Catalog Research Areas >> Cancer Research Areas >> Infection Signaling Pathways >> Others >> Others References [1]. Yang, Q, et al. (−)-Guaiol regulates RAD51 stability via autophagy to induce cell apoptosis in non-small cell lung cancer Oncotarget. 2016 Sep 20;7(38):62585-62597. [2]. Ali, A., Tabanca, et al. Chemical composition and biological activity of four salvia essential oils and individual compounds against two species of mosquitoes J. Agric. Food Chem. 63(2), 447-456 (2015). [3]. Liu, T, et al. Guaiol - a naturally occurring insecticidal sesquiterpene Nat. Prod. Commun. 8(10), 1353-1354 (2013). Chemical & Physical Properties Molecular Formula C15H26O Exact Mass 222.198364 PSA 20.23000 Index of Refraction 1.503 InChIKey TWVJWDMOZJXUID-SDDRHHMPSA-N
Transport InfoProduct name: Purity: 97.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available
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