3-hexen-1-ol 544-12-7

3-hexen-1-ol

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IUPAC name :

hex-3-en-1-ol

InChI :

InChI=1/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3

InChIKey :

UFLHIIWVXFIJGU-UHFFFAOYAQ

SMILES :

CCC=CCCO

(EINECS) number :	208-860-0
cas number :	544-12-7
fema number :	2563
coe number :	750
fl. number :	02.159
molar refractivity :	31.43 ± 0.3 cm3
parachor :	274.8 ± 4.0 cm3
index of refraction :	1.442 ± 0.02
surface tension :	28.7 ± 3.0 dyne/cm
density :	0.843 ± 0.06 g/cm3
polarizability :	12.46 ± 0.5 10-24cm3
xlogp :	1.50
molecular weight :	100.1588800
formula :	C6 H12 O

fda reg :

unspecified

h. number :

unspecified

organoleptics :

odor strength :

high ,
recommend smelling in a 1.00 % solution or less

odor description :
at 1.00 % in dipropylene glycol.

green leafy

properties :

appearence :

colorless to pale yellow clear liquid

assay :

95.00 - 100.00 % sum of isomers

Food Chemicals Codex Listed :

boiling point :

156.00 - 157.00 °C. @ 760.00 mm Hg

logp :

1.61

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

flash point ( Deg. F. ) :

130.00 °F. TCC ( 54.44 °C. )

recommendation for 3-hexen-1-ol usage levels up to :

2.0000 % in the fragrance concentrate.

safety links :

(EINECS) number :

208-860-0

chemidplus :

000544127

epa-srs :

544-12-7

other :

references :

fl. number :

02.159

pubchem :

154296

NIST Chemistry WebBook :

2578514958

synonyms :
	hex-3-en-1-ol
3-	hexen-1-ol
3-	hexenol
soluble in :
	alcohol
	water, 16000 mg/L @ 25C
(odor and/or flavor) blends with :
	acetaldehyde ethyl phenethyl acetal
	algae absolute
	allyl amyl glycolate
	allyl cyclohexyl propionate
iso	amyl benzoate
iso	amyl butyrate
iso	amyl salicylate
	anise seed oil
para-	anisyl acetate
	ascorbic acid
	bark carbaldehyde
	basil oil
	bay leaf oil
	benzyl acetate
	benzyl propionate
	bergamot oil
	bois de rose oil
	butyl heptanoate
iso	butyl quinoline
iso	butyl salicylate
sec-	butyl-3-methyl but-2-ene thioate
	cedarwood oils
	citronellyl acetate
	citrus carbaldehyde
	clary sage oil
	clary sage resin
	clover nitrile
	coriander seed oil
	cortex pyridine
para-	cresyl caprylate
	cyclamen aldehyde
	cyclohexyl ethyl alcohol
	dibutyl sulfide
	diethyl malonate
	dihydromyrcenol
	dimethyl benzyl carbinyl butyrate
3,7-	dimethyl-6-octenoic acid
	dodecanal
	dodecanol
	ethyl heptanoate
2-	ethyl pyridine
	fir balsam absolute
	fir needle oil
	floral pyranol
3-(2-	furyl) acrolein
	galbanum oil
	gardenia oxide
	geranyl acetate
	grapefruit oil
	grapefruit pentanol
	grass notes
	green acetate
(Z)-3-	hepten-1-ol
(Z)-4-	hepten-1-ol
3-	hepten-2-one
2-	heptenoic acid
	heptyl heptanoate
	hexanal dihexyl acetal
(Z)-3-	hexen-1-al
(Z)-3-	hexen-1-ol
(Z)-3-	hexen-1-yl acetate
(Z)-3-	hexen-1-yl benzoate
(Z)-3-	hexen-1-yl butyrate
(Z)-3-	hexen-1-yl formate
(Z)-3-	hexen-1-yl propionate
(Z)-3-	hexen-1-yl salicylate
(Z)-3-	hexen-1-yl tiglate
(Z)-3-	hexenoic acid
	hexyl 2-methyl butyrate
alpha-	hexyl cinnamaldehyde
	hexyl heptanoate
	hexyl isovalerate
	hexyl tiglate
	ho leaf oil
	hyacinth butanal
	hyacinth ether
	lavender absolute
	leaf acetal
	leerall
	lilac acetaldehyde
	lime oil
	linalool
laevo-	linalool
	linalool oxide
	linalyl acetate
	litsea cubeba oil
	melon carboxaldehyde
	melon nonenoate
	melon valerate
	methyl 2-methyl valerate
	methyl dihydrojasmonate
	methyl heptenone
	methyl heptine carbonate
	methyl octine carbonate
3-(	methyl thio) hexanal
2-	methyl-2-penten-1-al
	mimosa absolute
	mistletoe absolute
	muguet carboxaldehyde
	narcissus absolute
	nerol
	neryl acetate
(E,Z)-2,6-	nonadien-1-al
2,4-	nonadien-1-ol
(E,Z)-3,6-	nonadien-1-yl acetate
3,6-	nonadien-1-yl acetate
	nonanal
(Z)-3-	nonen-1-ol
	oakmoss absolute
	oakmoss concrete
	ocean propanal
(E,E)-3,5-	octadien-2-one
	octanal
(Z)-5-	octen-1-ol
3-	octen-2-ol
	orris pyridine
	peony alcohol
	pepper oil black
	petitgrain oil
	phenethyl acetate
	phenyl acetaldehyde
	phenyl acetaldehyde dimethyl acetal
3-	phenyl propionaldehyde
	propylene acetal
	rose butanoate
	rose oxides
	spruce oil
	styralyl acetate
alpha-	terpineol
alpha-	terpinyl acetate
	tetrahydrolinalool
	tetrahydromyrcenol
3,5,5-	trimethyl hexanol
gamma-	undecalactone
10-	undecen-1-ol
	violet methyl carbonate
	watermelon ketone
	wintergreen oil
	woody acetate
	woody amylene
(odor and/or flavor) used in :
	apple
	apple green apple
	apple red apple
	banana
	berry
	blackberry
	broccoli
	cabbage
	cedar
	cherry
	cherry blossom
	christmas blends
	citrus
	coconut tropical coconut
	cranberry
	cucumber
	currant red currant
	fig
	floral
	forest pine forest
	freesia
	fresh
	fruit
	gardenia
	geranium
	grape
	grapefruit
	grass green grass
	grass sweet grass
	greenhouse
	heliotrope
	herbal
	honeysuckle chevrefeuille
	hops houblon
	hyacinth jacinthe
	jasmin
	kiwi
	lavender
	leaf green leaf
	lilac lilas syringa
	lily
	linden blossom limeflower tilleul
	lotus
	magnolia
	mango
	melon watermelon muskmelon cantaloupe
	mint
	muguet lily of the valley
	mulberry
	neroli
	orange
	orchid
	outdoors fresh outdoors
	pea green pea
	peach
	pear
	peony
	petal flower petal
	pineapple
	plum
	potato
	raspberry
	raspberry black raspberry
	rose
	rose white rose
	strawberry
	strawberry leaf
	sweet pea pois de senteur
	tea green tea
	tomato
	tuberose tubereuse
	violet
natural occurrence in :
data page	basil flower oil sweet @ 0.03%
data page	basil leaf oil sweet (ocimum basilicum) @ 0.03%
data page	hyptis spicigera lam. oil mali @ trace-0.10%
data page	rue oil china @ 0.07%
data page	ylang ylang oil CO2 extract @ 0.11%

information only - not sold by The Good Scents Company.

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