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Key Documents

525162

Sigma-Aldrich

Sucrose diacetate hexaisobutyrate

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About This Item

Empirical Formula (Hill Notation):
C40H62O19
Molecular Weight:
846.91
EC Number:
MDL number:
UNSPSC Code:
12352202
PubChem Substance ID:

optical activity

[α]20/D +49°, c = 1 in chloroform

Quality Level

refractive index

n20/D 1.457 (lit.)

bp

288 °C (lit.)

mp

−7 °C (lit.)

density

1.146 g/mL at 25 °C (lit.)

SMILES string

CC(C)C(=O)OC[C@H]1O[C@H](O[C@@]2(COC(C)=O)O[C@H](COC(=O)C(C)C)[C@@H](OC(=O)C(C)C)[C@@H]2OC(=O)C(C)C)[C@H](OC(C)=O)[C@@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C

InChI

1S/C40H62O19/c1-18(2)33(43)51-17-40(32(57-38(48)23(11)12)29(54-35(45)20(5)6)27(58-40)16-50-25(14)42)59-39-31(56-37(47)22(9)10)30(55-36(46)21(7)8)28(53-34(44)19(3)4)26(52-39)15-49-24(13)41/h18-23,26-32,39H,15-17H2,1-14H3/t26-,27-,28-,29-,30+,31-,32+,39-,40+/m1/s1

InChI key

ZNEBZIJCDDCNRC-SWTLDUCYSA-N

Storage Class

10 - Combustible liquids

wgk_germany

nwg

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves


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