2,3-butane diol diacetate 1114-92-7

2,3-butane diol diacetate

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IUPAC name :

3-acetyloxybutan-2-yl acetate

InChI :

InChI=1/C8H14O4/c1-5(11-7(3)9)6(2)12-8(4)10/h5-6H,1-4H3

InChIKey :

VVSAAKSQXNXBML-UHFFFAOYAS

SMILES :

CC(C(C)OC(=O)C)OC(=O)C

cas number :	1114-92-7
(EINECS) number :	214-219-6
molar refractivity :	42.57 ± 0.3 cm3
parachor :	394.6 ± 4.0 cm3
index of refraction :	1.419 ± 0.02
surface tension :	30.2 ± 3.0 dyne/cm
density :	1.034 ± 0.06 g/cm3
polarizability :	16.87 ± 0.5 10-24cm3
XlogP :	1.20
XlogP3-AA :	0.90
molecular weight :	174.1943600 (IUPAC)
formula :	C8 H14 O4
NMR Predictor :	Predict

export tariff code :

unspecified

fda reg :

unspecified

Suppliers :

Nanjing :

butane-2,3-diyl diacetate

organoleptics :

properties :

assay :

95.00 to 100.00 %

Food Chemicals Codex Listed :

boiling point :

203.00 to 205.00 °C. @ 760.00 mm Hg

flash point :

194.00 °F. TCC ( 90.00 °C. )

logP (o/w) :

0.64

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

safety references :

EPI System :

view

3-acetyloxybutan-2-yl acetate

(EINECS) number :

214-219-6

chemidplus :

001114927

EPA Substance Registry Services :

1114-92-7

references :

3-acetyloxybutan-2-yl acetate

NIST Chemistry WebBook :

458683845

pubchem :

208269

other :

synonyms :
2-(	acetyl oxy)-1-methyl propyl acetate
2-(	acetyloxy)-1-methylpropyl acetate
3-	acetyloxybutan-2-yl acetate
	butane-2,3-diyl diacetate
2,3-	butanediol diacetate
2,3-	butanedioldiacetate
natural occurrence in :
	not found in nature

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