2-undecyl acetate 14936-67-5

2-undecyl acetate

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IUPAC name :

undecan-2-yl acetate

InChI :

InChI=1/C13H26O2/c1-4-5-6-7-8-9-10-11-12(2)15-13(3)14/h12H,4-11H2,1-3H3

InChIKey :

HABRKYMFOVMIBP-UHFFFAOYAS

SMILES :

CCCCCCCCCC(C)OC(=O)C

(EINECS) number :	239-011-2
cas number :	14936-67-5
molar refractivity :	64.00 ± 0.3 cm3
parachor :	571.4 ± 4.0 cm3
index of refraction :	1.431 ± 0.02
surface tension :	28.6 ± 3.0 dyne/cm
density :	0.867 ± 0.06 g/cm3
polarizability :	25.37 ± 0.5 10-24cm3
xlogp :	5.50
molecular weight :	214.3443400
formula :	C13 H26 O2

export tariff code :

unspecified

fda reg :

unspecified

organoleptics :

properties :

appearence :

colorless clear liquid

assay :

97.00 to 100.00 %

Food Chemicals Codex Listed :

boiling point :

248.00 to 249.00 °C. @ 760.00 mm Hg

logp :

5.31

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

flash point ( Deg. F. ) :

220.00 °F. TCC ( 104.44 °C. )

safety references :

EPI System :

view

undecan-2-yl acetate

(EINECS) number :

239-011-2

chemidplus :

014936675

EPA Substance Registry Services :

14936-67-5

NLM Chemical Carcinogenesis Research Information System :

14936-67-5

NLM Developmental and Reproductive Toxicity :

14936-67-5

NLM Env. Mutagen Info. Center :

14936-67-5

NLM GENetic TOXicology :

14936-67-5

references :

undecan-2-yl acetate

pubchem :

662656

other :

synonyms :
	acetic acid 1-methyl decyl ester
1-	methyl decyl acetate
2-	undecanol acetate
2-	undecyl acetate
soluble in :
	alcohol
insoluble in :
	water
natural occurrence in :
data page	rue oil china @ 3.04%

information only - not sold by The Good Scents Company.

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