Sucrose

Ai3-09085 · 1-alpha-D-Glucopyranosyl-2-beta-D-fructofuranoside

Identifikatoren & physikalische Daten

CAS No.	57-50-1
Summenformel	C12H22O11
Durchschnittliche Molmasse	342,3 g/mol
Monoisotopische Masse	342,11621152 g/mol
SMILES	OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChIKey	CZMRCDWAGMRECN-UGDNZRGBSA-N
PubChem CID	5988
ChEMBL	CHEMBL253582
ChEBI	CHEBI:17992
EC No.	200-334-9
DTXSID	DTXSID2021288

Chemische & physikalische Eigenschaften

XLogP	-3,7
Polarare Oberfläche (TPSA)	190
H-Brücken-Donoren	8
H-Brücken-Akzeptoren	11
Frei drehbare Bindungen	5
Schwere Atome	23
Formalladung	0
Komplexität	395
Stoffklassen	Biological Agents -> Disaccharides
Arzneimittel	Pharmaceuticals -> Listed in ZINC15
Kosmetika	Cosmetic ingredients (Sucrose) -> CIR (Cosmetic Ingredient Review)SoothingHumectantSkin conditioning
pH	Soln are neutral to litmus
SpringerMaterials Properties	Chemical diffusion
Pestizide	Agrochemicals -> Pesticide active substancesActive substance -> EU Pesticides database: Approved
LogP (Verteilungskoeffizient)	log Kow = -3.70-3.67-2.7
Geruch	Characteristic caramel... Odorless ... [Note: May have a characteristic caramel odor when heated].
Geschmack	Sweet
Lebensmittelzusatzstoffe	NUTRITIVE SWEETENER -> FDA Substance added to food
Dichte	1.59 at 68 °F (USCG, 1999) - Denser than waterwill sink1.5805 g/cu cm @ 17 °C1.6 g/cm³
Color/Form	Monoclinic sphenoidal crystals, crystalline masses, blocks, or powderHard, white ... crystals, lumps, or powder ...

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 95.7% (423 of 442) of all reports.Not ClassifiedAggregated GHS information provided per 442 reports by companies from 8 notifications to the ECHA C&L Inventory.
Regulatorische Informationen	Chemical: .alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl.alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of .alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Reg. (EU) No 916/2014Sucrose: Does not have an individual approval but may be used under an appropriate group standard
Weitere Sicherheitsinformationen	IMAP assessments - .alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl: Human health tier I assessment
Brandgefahren	Special Hazards of Combustion Products: Irritating fumes may form in fires.Combustible. Finely dispersed particles form explosive mixtures in air.
Gesundheitsgefahren	None (USCG, 1999)
Gefahrenübersicht	May cause mechanical irritation.[ICSC]
FDA-Anforderungen	Substance added directly to human food affirmed as generally recognized as safe (GRAS).
Reaktive Gruppe	Alcohols and Polyols
Special Reports	INFORMATICS INCSCIENTIFIC LITERATURE REVIEWS ON GENERALLY RECOGNIZED AS SAFE (GRAS) FOOD INGREDIENTS: SUCROSEUS NTIS PB REPORT PB-228 548, 202 PP. (1973). LITERATURE REVIEW OF SUCROSE AND ITS USE IN FOOD PRODUCTS.
EPA Safer Chemical	Chemical: Sucrose
FIFRA-Anforderungen	Residues of sucrose are exempted from the requirement of a tolerance when used as a solid diluent, carrier or safener in accordance with good agricultural practices as inert (or occasionally active) ingredients in pesticide formulations applied to growing crops or to raw agricultural commodities after harvest.