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sucrose acetate isobutyrate

Molecular FormulaC₄₀H₆₂O₁₉
Average mass846.909 Da
Monoisotopic mass846.388550 Da
ChemSpider ID29072

- 9 of 9 defined stereocentres

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Names and Synonyms
Database ID(s)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Sucrose 6,6'-acetate hexaisobutyrate

126-13-6 [RN]

1-O-Acetyl-3,4,6-tri-O-isobutyryl-b-D-fructofuranosyl 6-O-acetyl-2,3,4-tri-O-isobutyryl-a-D-glucopyranoside

1-O-Acetyl-3,4,6-tri-O-isobutyryl-β-D-fructofuranosyl 6-O-acetyl-2,3,4-tri-O-isobutyryl-α-D-glucopyranoside [ACD/IUPAC Name]

1-O-Acetyl-3,4,6-tri-O-isobutyryl-β-D-fructofuranosyl-6-O-acetyl-2,3,4-tri-O-isobutyryl-α-D-glucopyranosid [German] [ACD/IUPAC Name]

1-O-acetyl-3,4,6-tris-O-(2-methylpropanoyl)-β-D-fructofuranosyl 6-O-acetyl-2,3,4-tris-O-(2-methylpropanoyl)-α-D-glucopyranoside

27216-37-1 [RN]

34482-63-8 [RN]

6-O-Acétyl-2,3,4-tri-O-isobutyryl-α-D-glucopyranoside de 1-O-acétyl-3,4,6-tri-O-isobutyryl-β-D-fructofuranosyle [French] [ACD/IUPAC Name]

sucrose acetate isobutyrate

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Sucrose diacetate hexaisobutyrate

α-D-Glucopyranoside, 1-O-acetyl-3,4,6-tris-O-(2-methyl-1-oxopropyl)-β-D-fructofuranosyl, 6-acetate 2,3,4-tris(2-methylpropanoate) [ACD/Index Name]

[(2R,3R,4S,5S)-5-[(acetyloxy)methyl]-5-{[(2R,3R,4S,5R,6R)-6-[(acetyloxy)methyl]-3,4,5-tris[(2-methylpropanoyl)oxy]oxan-2-yl]oxy}-3,4-bis[(2-methylpropanoyl)oxy]oxolan-2-yl]methyl 2-methylpropanoate

[(2S,3S,4R,5R)-2-(Acetoxymethyl)-2-[(2R,3R,4S,5R,6R)-6-(Acetoxymethyl)-3,4,5-Tris(2-Methylpropanoyloxy)Tetrahydropyran-2-Yl]Oxy-4-(2-Methylpropanoyloxy)-5-(2-Methylpropanoyloxymethyl)Tetrahydrofuran-3

[27216-37-1] [RN]

1-O-Acetyl-3,4,6-tri-O-isobutyryl-?-D-fructofuranosyl6-O-acetyl-2,3,4-tri-O-isobutyryl-?-D-glucopyranoside

2-methylpropanoic acid [(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methyl-1-oxopropoxy)-2-oxanyl]oxy]-3,4-bis(2-methyl-1-oxopropoxy)-2-oxolanyl]methyl ester[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)oxan-2-yl]oxy-3,4-bis(2-methylpropanoyloxy)oxolan-2-yl]methyl 2-methylpropanoate

6-O-Acetyl-1,3,4-tris-O-(2-methyl-1-oxopropyl)-β-D-fructofuranosyl α-D-glucopyranoside 6-acetate 2,3,4-tris(2-methylpropanoate)

a-D-Glucopyranoside,6-O-acetyl-1,3,4-tris-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl, 6-acetate2,3,4-tris(2-methylpropanoate)

-D-Glucopyranoside, 6-O-acetyl-1,3,4-tris-O-( 2-methyl-1-oxopropyl)-D-fructofuranosyl, 6-acetate 2,3,4-tris(2-methylpropanoate)

EINECS 204-771-6

Isobutyric acid, hexaester with sucrose diacetate

Isobutyric acid, hexaester with sucrose diacetate (8CI)

MFCD00041859

SACCHAROSE ACETATE ISOBUTYRATE

SAIB

SAIB 100S

Sucrose acetate 2-methylpropanoate

Sucrose acetoisobutyrate

SUCROSE DI(ACETATE) HEXAISOBUTYRATE

Sucrose diacetate hexaisobutyrate, 8CI

Sucrose, diacetate hexaisobutyrate

-Yl] 2-Methylpropanoate

α-D-Glucopyranoside, 6-O-acetyl-1,3,4-tris-O-(2-methyl-1-oxopropyl)-β-D-fructofuranosyl, 6-acetate 2,3,4-tris(2-methylpropanoate) [ACD/Index Name]

α-D-Glucopyranoside, β-D-fructofuranosyl, diacetate hexakis(2-methylpropanoate)

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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

H5KI1C3YTV [DBID]

AI3-25354 [DBID]

HSDB 5657 [DBID]

UNII:H5KI1C3YTV [DBID]

UNII-H5KI1C3YTV [DBID]

Experimental data
Predicted - ACD/Labs
Predicted - ChemAxon

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:	1.2±0.1 g/cm³
Boiling Point:	758.6±60.0 °C at 760 mmHg
Vapour Pressure:	0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization:	110.5±3.0 kJ/mol
Flash Point:	296.6±32.9 °C
Index of Refraction:	1.500
Molar Refractivity:	203.0±0.4 cm³
#H bond acceptors:	19
#H bond donors:	0
#Freely Rotating Bonds:	27
#Rule of 5 Violations:	3

ACD/LogP:	8.46
ACD/LogD (pH 5.5):	7.32
ACD/BCF (pH 5.5):	216879.67
ACD/KOC (pH 5.5):	229742.25
ACD/LogD (pH 7.4):	7.32
ACD/BCF (pH 7.4):	216879.67
ACD/KOC (pH 7.4):	229742.25
Polar Surface Area:	238 Å²
Polarizability:	80.5±0.5 10^-24cm³
Surface Tension:	47.0±5.0 dyne/cm
Molar Volume:	690.0±5.0 cm³

Click to predict properties on the Chemicalize site

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sucrose acetate isobutyrate

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