2-decalinol
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IUPAC name :1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
InChI :InChI=1/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2
InChIKey :UPMAOXLCTXPPAG-UHFFFAOYAM
SMILES :C1CCC2CC(CCC2C1)O
cas number :825-51-4
(EINECS) number :212-545-3
beilstein number :0773927
molar refractivity :45.76 ± 0.3 cm3
parachor :375.8 ± 4.0 cm3
index of refraction :1.500 ± 0.02
surface tension :34.2 ± 3.0 dyne/cm
density :0.992 ± 0.06 g/cm3
polarizability :18.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 154.2493200
formula :C10 H18 O
BioActivity Analysis :69009
 
 
IUPAC name :(2R,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
InChI :InChI=1/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9+,10+/m0/s1
InChIKey :UPMAOXLCTXPPAG-IVZWLZJFBT
SMILES :C1CC[C@@H]2C[C@@H](CC[C@@H]2C1)O
cas number :825-51-4  (RSR)
molar refractivity :45.76 ± 0.3 cm3
parachor :375.8 ± 4.0 cm3
index of refraction :1.500 ± 0.02
surface tension :34.2 ± 3.0 dyne/cm
density :0.992 ± 0.06 g/cm3
polarizability :18.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 154.2493200
formula :C10 H18 O
 
 
IUPAC name :(2R,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
InChI :InChI=1/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9-,10+/m0/s1
InChIKey :UPMAOXLCTXPPAG-LPEHRKFABU
SMILES :C1CC[C@H]2C[C@@H](CC[C@@H]2C1)O
cas number :825-51-4  (RSS)
molar refractivity :45.76 ± 0.3 cm3
parachor :375.8 ± 4.0 cm3
index of refraction :1.500 ± 0.02
surface tension :34.2 ± 3.0 dyne/cm
density :0.992 ± 0.06 g/cm3
polarizability :18.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 154.2493200
formula :C10 H18 O
 
 
IUPAC name :(2S,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
InChI :InChI=1/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9+,10-/m0/s1
InChIKey :UPMAOXLCTXPPAG-AEJSXWLSBI
SMILES :C1CC[C@@H]2C[C@H](CC[C@@H]2C1)O
cas number :825-51-4  (SSR)
molar refractivity :45.76 ± 0.3 cm3
parachor :375.8 ± 4.0 cm3
index of refraction :1.500 ± 0.02
surface tension :34.2 ± 3.0 dyne/cm
density :0.992 ± 0.06 g/cm3
polarizability :18.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 154.2493200
formula :C10 H18 O
 
 
IUPAC name :(2S,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
InChI :InChI=1/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9-,10-/m0/s1
InChIKey :UPMAOXLCTXPPAG-GUBZILKMBO
SMILES :C1CC[C@H]2C[C@H](CC[C@@H]2C1)O
cas number :825-51-4  (SSS)
molar refractivity :45.76 ± 0.3 cm3
parachor :375.8 ± 4.0 cm3
index of refraction :1.500 ± 0.02
surface tension :34.2 ± 3.0 dyne/cm
density :0.992 ± 0.06 g/cm3
polarizability :18.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 154.2493200
formula :C10 H18 O
 
 
export tariff code :unspecified
fda reg :unspecified
Suppliers :
Penta :decahydro-beta-naphthol
Sigma-Aldrich-SAFC :Decahydro-2-naphthol
97%
organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  		clean rose minty muguet
odor sample from :International Flavors & Fragrances Inc.
properties :
appearence :colorless clear viscous liquid
assay : 98.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.99400 to 0.99700 @ 25.00 °C.
pounds per gallon - calc. : 8.271 to 8.296
refractive index :1.49800 to 1.50400 @ 20.00 °C.
boiling point : 109.00 °C. @ 14.00 mm Hg
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 2.89
safety :
most important hazard(s) :Xi - Irritant
  R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) :
  Oral-Rat    >5000.00  mg/kg

Dermal Toxicity(LD50) :
  Skin-Rabbit  >5000.00  mg/kg

Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for 2-decalinol usage levels up to :
  5.0000 % in the fragrance concentrate.
recommendation for 2-decalinol usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
(EINECS) number :212-545-3
RTECS :QK4240000 for 825-51-4
chemidplus :000825514
EPA Substance Registry Services :825-51-4
dtp/nci :2332
 (2R,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2R,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2S,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2S,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
references :
 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
NIST Chemistry WebBook :1462611259
pubchem :156569
 (2R,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2R,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2S,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 (2S,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
synonyms :
(Z+E)-decahydro-2-naphthol
 decahydro-beta-naphthol
(Z+E)-decahydro-beta-naphthol
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
 decahydronaphthol-2
2-decalol
2-hydroxydecalin
soluble in :
 alcohol
 water, 1260 mg/L @ 25C
insoluble in :
 water
(odor and/or flavor) blends with :
 citronellyl ethoxalate
 citronellyl ethyl ether
 citronellyl oxyacetaldehyde
 cumin carbinol
 cyclamen homoaldehyde
 cyclohexyl ethyl acetate
 cyclohexyl propanol
(Z)-4-decen-1-al
 dihydrocitronellyl ethyl ether
 dimethyl octanyl acetate
 ethyl linalyl acetal
(E,E)-farnesol
 floral butanal
 floral pyranol
 geranium absolute
 geranium oil china
(Z)-geranyl ethyl ether
 hawthorn ethanol
 jasimia
 leerall
 lilyall
 lilyall / methyl anthranilate schiff's base
 magnolia cyclohexanol
laevo-menthyl acetate
 methoxycitronellal
 muguet butanal
 muguet butanol
 muguet carboxaldehyde
 muguet ethanol
 muguet nitrile
 muguet propanol
 muguet shiseol
 muguet undecadienal
 myrmac aldehyde
 phenyl glycol diacetate
(odor and/or flavor) used in :
 diffusion
 floral
 jasmin
 lily
 oriental
 rose
natural occurrence in :
not found in nature



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