2-ethyl fenchol + arbanol 67952-68-5

2-ethyl fenchol + arbanol

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IUPAC name :

2-ethyl-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol

InChI :

InChI=1/C12H22O/c1-5-12(13)10(2,3)9-6-7-11(12,4)8-9/h9,13H,5-8H2,1-4H3

InChIKey :

KIPCKEJKGCXRGA-UHFFFAOYAD

SMILES :

OC2(CC)C1(C)CCC(C1)C2(C)C

cas number :	67952-68-5
(EINECS) number :	267-922-5
molar refractivity :	55.08 ± 0.3 cm3
parachor :	469.7 ± 4.0 cm3
index of refraction :	1.487 ± 0.02
surface tension :	36.2 ± 3.0 dyne/cm
density :	0.952 ± 0.06 g/cm3
polarizability :	21.83 ± 0.5 10-24cm3
XlogP :	3.10
molecular weight :	182.3024800
formula :	C12 H22 O
NMR Predictor :	Predict

export tariff code :

3302.90.0050

fda reg :

unspecified

Suppliers :

Bedoukian Research :

TERRASOL 50
Odor: earthy, fresh soil

organoleptics :

odor strength :

medium ,
recommend smelling in a 10.00 % solution or less

odor description :¹
at 10.00 % in dipropylene glycol.

earthy soil

odor sample from :

Bedoukian Research, Inc.

properties :

appearence :

colorless clear liquid

assay :

95.00 to 100.00 % sum of isomers

Food Chemicals Codex Listed :

specific gravity :

0.97100 to 0.98100 @ 25.00 °C.

pounds per gallon - calc. :

8.080 to 8.163

refractive index :

1.47800 to 1.48800 @ 20.00 °C.

vapor density :

>1 ( Air = 1 )

flash point :

200.00 °F. TCC ( 93.33 °C. )

safety :

most important hazard(s) :

None - None found.

S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

recommendation for 2-ethyl fenchol + arbanol usage levels up to :

6.0000 % in the fragrance concentrate.

recommendation for 2-ethyl fenchol + arbanol 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-ethyl-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol

(EINECS) number :

267-922-5

chemidplus :

067952685

EPA Substance Registry Services :

67952-68-5

references :

2-ethyl-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol

pubchem :

684201

other :

reference :

Luebke, William tgsc, (1988)¹

synonyms :
2-	ethyl fenchol + cedranol
	ethyl-1,3,3-trimethyl bicyclo(2.2.1)heptan-2-ol
2-	ethyl-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol
	terrasol 50 in arbanol
soluble in :
	alcohol
insoluble in :
	water
(odor and/or flavor) used in :
	earth humus
	herbal
	earth humus
	moss
	woody
natural occurrence in :
	not found in nature

information only - not sold by The Good Scents Company.

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