amber butanol 139504-68-0

amber butanol

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IUPAC name :

1-(2-tert-butylcyclohexyl)oxybutan-2-ol

InChI :

InChI=1/C14H28O2/c1-5-11(15)10-16-13-9-7-6-8-12(13)14(2,3)4/h11-13,15H,5-10H2,1-4H3

InChIKey :

GQBVHGLNSHPKPG-UHFFFAOYAH

SMILES :

CCC(COC1CCCCC1C(C)(C)C)O

(EINECS) number :	412-300-2
eu annex :	603-154-00-2
cas number :	139504-68-0
molar refractivity :	68.03 ± 0.4 cm3
parachor :	588.7 ± 6.0 cm3
index of refraction :	1.463 ± 0.03
surface tension :	32.3 ± 5.0 dyne/cm
density :	0.92 ± 0.1 g/cm3
polarizability :	26.97 ± 0.5 10-24cm3
xlogp :	3.90
molecular weight :	228.3709200
formula :	C14 H28 O2

export tariff code :

2909.49.090

fda reg :

unspecified

organoleptics :

odor type :

amber

odor strength :

medium

odor description :
at 100.00 %.

woody amber

properties :

appearence :

colorless clear liquid

assay :

98.00 - 100.00 %

Food Chemicals Codex Listed :

specific gravity :

0.93100 - 0.94100 @ 20.00 °C.

pounds per gallon - calc. :

7.756 to 7.839

refractive index :

1.46100 - 1.47100 @ 20.00 °C.

boiling point :

272.00 - 273.00 °C. @ 760.00 mm Hg

logp :

3.86

safety :

most important hazard(s) :

Xi - Irritant

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

flash point ( Deg. F. ) :

230.00 °F. TCC ( 110.00 °C. )

recommendation for amber butanol usage levels up to :

4.0000 % in the fragrance concentrate.

recommendation for amber butanol usage levels up to :

not for flavor use.

safety links :

(EINECS) number :

412-300-2

chemidplus :

139504680

epa-srs :

139504-68-0

other :

references :

pubchem :

741862

synonyms :
	amber butanol
	amber core
2-tert-	butyl cyclohexyl oxy-2-butanol
1-(2-tert-	butyl cyclohexyl oxy)-2-butanone
ortho-tert-	butyl cyclohexyl oxybutanol-2
1-((2-(1,1-	dimethyl ethyl)cyclohexyl)oxy)-2-butanol
soluble in :
	alcohol
insoluble in :
	water
stability :
	ph from 2 - 12
(odor and/or flavor) blends with :
	acetoxymethyl isolongifolene
	acetyl cedrene
	amber acetate
	amber carane
	amber carbinol
	amber cyclohexanol
	amber dioxane
	amber formate
	amber naphthofuran
	amber oxepin
	angelica seed oil
	apple ketal
	bergoxane
	bicyclogermacrene
	bornyl salicylate
	boronia butenal
beta-	cadinene
alpha-	campholenic aldehyde
alpha-	cedrene epoxide
	cedryl formate
	cumin acetaldehyde
iso	cyclogeraniol
	elemi oil
alpha-	elemol
iso	eugenyl formate
	formoxymethyl isolongifolene
	fresh nitrile
	galbanum oil
	galbanum oleoresin
	galbanum resinoid
	heptanol
(E)-2-	hexen-1-yl salicylate
6-	hydroxydihydrotheaspirane (mixture of isomers)
	hydroxymethyl isolongifolene 50% in dpg
iso	longifolene ketone
	mcp acetate
2-	methoxy-4-vinyl phenol
para-	methyl hydratropaldehyde
alpha-	methylene citronellal
	neroli ketone
(Z)-6-	nonen-1-al
	oakmoss absolute
	octanal propylene glycol acetal
2-	octanol
	opoponax absolute
	opoponax resinoid
	orange leaf absolute
	peanut oxazole
2-	pentyl cyclopentanone
	satinaldehyde
	sclarene
	sclareol
	sclareolide
	styrax oil
	styrax resinoid
	terpinyl propionate
	tobacco dodecane
	tricyclo(5.2.1.02,6)dec-3-enyl acetate
	valerian absolute
	valerian root oil
	valerian root oil china
	valerian root oil CO2 extract china
	woody cyclohexanone
	woody dioxolane
	woody fern notes
	woody nonane
(odor and/or flavor) used in :
	amber
	chypre
	citrus
	fern fougere
	muguet lily of the valley
	oriental
natural occurrence in :
	not found in nature

information only - not sold by The Good Scents Company.

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