(R)-(+)-beta-citronellol 1117-61-9

(R)-(+)-beta-citronellol

Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).

IUPAC name :

(3R)-3,7-dimethyloct-6-en-1-ol

InChI :

InChI=1/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m1/s1

InChIKey :

QMVPMAAFGQKVCJ-SNVBAGLBBU

SMILES :

CC(CCC=C(C)C)CCO

(EINECS) number :	214-250-5
cas number :	1117-61-9
beilstein number :	1721506
molar refractivity :	49.77 ± 0.3 cm3
parachor :	427.5 ± 4.0 cm3
index of refraction :	1.450 ± 0.02
surface tension :	28.5 ± 3.0 dyne/cm
density :	0.845 ± 0.06 g/cm3
polarizability :	19.73 ± 0.5 10-24cm3
xlogp :	3.30
molecular weight :	156.2652000
formula :	C10 H20 O

export tariff code :

unspecified

fda reg :

unspecified

organoleptics :

odor type :

floral

odor strength :

medium

odor description :
at 100.00 %.

citronella oil rose leaf oily petal

properties :

appearence :

colorless to pale yellow clear liquid

assay :

98.00 - 100.00 %

Food Chemicals Codex Listed :

specific gravity :

0.85700 @ 25.00 °C.

refractive index :

1.45600 @ 20.00 °C.

boiling point :

221.00 - 224.00 °C. @ 760.00 mm Hg

boiling point :

112.00 - 113.00 °C. @ 12.00 mm Hg

logp :

3.38

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

flash point ( Deg. F. ) :

213.00 °F. TCC ( 100.56 °C. )

IFRA critical Effect :

Sensitization

Fragrance usage is RESTRICTED to :

Please review all IFRA documents for complete information. (QRA)

IFRA categories : limits in the finished product: (For a description of the categories, refer to the IFRA QRA Information Booklet.)

Category 1 :

0.80 % (1)

Category 2 :

1.10 %

Category 3 :

4.40 %

Category 4 :

13.30 %

Category 5 :

7.00 %

Category 6 :

21.40 % (1)

Category 7 :

2.20 %

Category 8 :

2.00 %

Category 9 :

5.00 %

Category 10 :

2.50 %

Category 11 :

See Note

(1) IFRA would recommend that any material used to impart perfume or flavour in products intended for human ingestion should consist of ingredients that are in compliance with appropriate regulations for foods and food flavourings in the countries of planned distribution and, where these are lacking, with the recommendations laid down in the Code of Practice of IOFI (International Organisation of the Flavor Industry). Further information about IOFI can be found on its website (www.iofi.org).

Note : Category 11 includes all non-skin contact or incidental skin contact products. Due to negligible skin contact, the concentration of a fragrance ingredient should not exceed the usual concentration of the fragrance compound in the finished product.

For example, hypothetically if the usual concentration of a fragrance compound in the final product, for example a candle, is at 5%, then any individual fragrance ingredient (in this case (R)-(+)-beta-citronellol) must not exceed 5% in the candle.

safety links :

(EINECS) number :

214-250-5

rtecs :

RH3400000 for 1117-61-9

chemidplus :

001117619

epa-srs :

1117-61-9

other :

references :

pubchem :

679419

synonyms :
(R)-(+)-	citronellol
(R)-(+)-beta-	citronellol
dextro-	dihydrogeraniol
(R)-3,7-	dimethyl oct-6-en-1-ol
(3R)-3,7-	dimethyl-6-octen-1-ol
(R)-3,7-	dimethyl-6-octen-1-ol
soluble in :
	alcohol
insoluble in :
	water
(odor and/or flavor) used in :
	floral
	geranium
	lilac lilas syringa
	lily
	rose
natural occurrence in :
	found in nature

information only - not sold by The Good Scents Company.

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