Identification and Related Records
- 【Name】
- Sucralose
- 【Iupac name】
- (2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5S)-2,5-bis(chloromethyl)-3,
4-dihydroxyoxolan-2-yl]oxy-5-chloro-6-(hydroxymethyl)oxane-3,4-diol
- 【Registry number】
- 56038-13-2 (CAS DataBase Reference)
- 【Synonyms】
-
Trichlorosucrose
4,1,6-Trichloro-4,1,6-trideoxy-galacto-sucrose
1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactose
1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactopyranoside
See R-D-Galactopyranoside,1,6-dichloro-1,6- dideoxy-a-D-fructofuranosyl 4-chloro-4-deoxy-
Sucralose (Trichlorosucorose)
Sucralose Fccv
Sucralose [BAN]
(2R,3R,4R,5S,6R)-2-[(2R,3S,4S,5S)-2,5-bis(chloromethyl)-3,4-dihydroxy-oxolan-2-yl]oxy-5-chloro-6-(hydroxymethyl)oxane-3,4-diol
- 【EINECS(EC#)】
- 259-952-2
- 【Molecular Formula】
- C12H19Cl3O8 (Products with the same molecular formula)
- 【Molecular Weight】
- 397.63346
- 【Inchi】
- InChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1
- 【InChIKey】
- BAQAVOSOZGMPRM-QBMZZYIRSA-N
- 【Canonical SMILES】
- C(C1C(C(C(C(O1)OC2(C(C(C(O2)CCl)O)O)CCl)O)O)Cl)O
- 【Isomers smiles】
- C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CCl)
O)O)CCl)O)O)Cl)O
Chemical and Physical Properties
- 【Appearance】
- White crystalline powder
- 【Density】
- 1.69 g/cm3
- 【Melting Point】
- 125.5 °C
- 【Boiling Point】
- 669.4 °C at 760 mmHg
- 【Refractive Index】
- 1.604
- 【Flash Point】
- 358.7 °C
- 【Water】
- 283g/L (20 °C) in water
- 【Solubilities】
- 283g/L (20 °C) in water
- 【Computed Properties】
- Molecular Weight:397.63346 [g/mol]
Molecular Formula:C12H19Cl3O8
XLogP3:-1.5
H-Bond Donor:5
H-Bond Acceptor:8
Rotatable Bond Count:5
Exact Mass:396.014551
MonoIsotopic Mass:396.014551
Topological Polar Surface Area:129
Heavy Atom Count:23
Formal Charge:0
Complexity:405
Isotope Atom Count:0
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:8
Feature 3D Donor Count:5
Feature 3D Ring Count:2
Effective Rotor Count:7.2
Conformer Sampling RMSD:0.8
CID Conformer Count:4
Safety and Handling
- 【Hazard Codes】
- Xi: Irritant;
- 【Risk Statements】
- R36/37/38
- 【Safety Statements 】
- 26-37/39
- 【Safety】
-
Hazard Codes:??
Xi
Risk Statements:? 36/37/38?
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements:? 26-37/39?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.?
S37/39:Wear suitable gloves and eye/face protection.
RTECS: LW5440140
- 【Specification】
-
?Sucralose (CAS NO.56038-13-2) is a zero-calorie sugar substitute artificial sweetener. Sucralose is approximately 600 times as sweet as sucrose (table sugar), it is stable under heat and over a broad range of pH conditions. So it can be used in baking or in products that require a longer shelf life. Sucralose is typically added to foods in very small quantities. The classification code of Sucralose (CAS NO.56038-13-2) are flavoring agents, food additives, sweetening agents.
Biomedical Effects and Toxicity
- 【Pharmacological Action】
- - Substances that sweeten food, beverages, medications, etc., such as sugar, saccharine or other low-calorie synthetic products. (From Random House Unabridged Dictionary, 2d ed)
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