Sucrose

HCID 5988

Basic information

CAS
57-50-1
Standard 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
Molecular formula
C12H22O11
Average molar mass
342.3 g/mol
Monoisotopic mass
342.11621152

Overview

Sucrose appears as white odorless crystalline or powdery solid. Denser than water.

Names & identifiers

Preferred name
Sucrose
IUPAC
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
English name
Beet sugar
Molecular formula
C12H22O11
Molecular weight
0

Names & synonyms

sucrose57-50-1saccharosesugarTable sugarCane sugarWhite sugarSaccharumMicroseRock candyAmerfandConfectioner's sugar
Show more names
Ai3-090851-alpha-D-Glucopyranosyl-2-beta-D-fructofuranoside
SucraloxumAmerfondbeta-D-Fructofuranosyl-alpha-D-glucopyranosidebeta-D-Fructofuranosyl alpha-D-glucopyranosideDTXSID2021288alpha-D-Glucopyranosyl beta-D-fructofuranosideNCI-C56597(+)-Sucrose

Database identifiers

CAS
57-50-1、92004-84-7
PubChem CID
5988
DTXSID
DTXSID2021288
ChEMBL
CHEMBL253582
ChEBI
CHEBI:17992
UNII
C151H8M554
EC Number
200-334-9、618-806-1
Nikkaji
J4.581K

Properties

Computed structural properties

XLogP
-3.7
Topological polar surface area
190 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
11
Rotatable bonds
5
Heavy atoms
23

Experimental & physicochemical properties

Chemical ClassesBiological Agents -> Disaccharides
DrugsPharmaceuticals -> Listed in ZINC15
Cosmetics · 2 items

Cosmetic ingredients (Sucrose) -> CIR (Cosmetic Ingredient Review)

Soothing; Humectant; Skin conditioning

pHSoln are neutral to litmus
SpringerMaterials PropertiesChemical diffusion
Pesticides · 2 items

Agrochemicals -> Pesticide active substances

Active substance -> EU Pesticides database: Approved

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 95.7% (423 of 442) of all reports.

Not Classified

Aggregated GHS information provided per 442 reports by companies from 8 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 4 items

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 916/2014

Sucrose: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - .alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl: Human health tier I assessment
Fire Hazards · 2 items

Special Hazards of Combustion Products: Irritating fumes may form in fires.

Combustible. Finely dispersed particles form explosive mixtures in air.

Health HazardsNone (USCG, 1999)
Hazards SummaryMay cause mechanical irritation.; [ICSC]
FDA RequirementsSubstance added directly to human food affirmed as generally recognized as safe (GRAS).

Safety & protection

Fire Fighting · 2 items

Fire Extinguishing Agents: Water (USCG, 1999)

Use water spray, powder, alcohol-resistant foam, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 3 items

Fresh air, rest.

Rinse skin with plenty of water or shower.

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

First Aid · 2 items

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. If symptoms (such as redness or irritation) develop, immediately transport the victim to a hospital.

(General first aid procedures)

Safe StorageSeparated from strong oxidants.
Firefighting HazardsIrritating fumes may form in fires.
Fire Fighting ProceduresWater

Toxicology

Target OrgansEyes, respiratory system
Adverse EffectsACGIH Carcinogen - Not Classifiable.
Exposure Routes · 2 items

The substance can be absorbed into the body by inhalation and by ingestion.

inhalation, skin and/or eye contact

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Signs and Symptoms · 4 items

Cough.

Redness. Roughness.

Redness.

irritation eyes, skin, upper respiratory system; cough

Natural Pollution Sources · 3 items

Occurs in low percentages in honey and maple sap

Sugar cane contains from 15-20% and sugar beet from 10-17% sucrose

The quantity of sucrose synthesized by all plants on earth is estimated to be 150X10+9 t/a.

Regulatory information

FDA RequirementsSubstance added directly to human food affirmed as generally recognized as safe (GRAS).
FIFRA Requirements · 2 items

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.

Sucrose is exempted from the requirement of a tolerance when used as a solid diluent or carrier in accordance with good agricultural practice as inert (or occasionally active) ingredients in pesticide formulations applied to animals.

Chemistry & industry

Pharmacology

MeSH Pharmacological ClassificationSubstances that sweeten food, beverages, medications, etc., such as sugar, saccharine or other low-calorie synthetic products. (From Random House Unabridged Dictionary, 2d ed)
Tissue LocationsAdipose Tissue
Cellular LocationsExtracellular
Metabolite PathwaysGalactose Metabolism

Uses & manufacturing

Uses · 6 items

CIR ingredient: Sucrose

Obtained from cane sugar, sugar beet, and sorghum; Used as a sweetener; [ChemIDplus]

For Sucrose (USEPA/OPP Pesticide Code: 000023) there are 0 labels match. /SRP: Not registered for current use in the U.S., but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses./

FLAVOR BLENDER, ACCENTUATOR, MODIFIER & DISPERSING AGENT, SWEETENING, TEXTURE & BODYING AGENT FOR FOODS & BEVERAGES; RAW MATERIAL FOR NUMEROUS ORG CHEM & YEAST PRODN; LUBRICANT IN FOODS

Sweetener in foods and soft drinks, manufacture of syrups, source of invert sugar, confectionary, preserves and jams, demulcent, pharmaceutical products, caramel, chemical intermediate for detergents, emulsifying agents, and other sucrose derivatives.

Sweetening agent and food. Starting material in fermentative prodn of ethanol, butanol, glycerol, citric and levulinic acids. Used in pharmaceuticals as a flavor, as a preservative, as antioxidant (in form of invert sugar), as demulcent, as substitute for glycerol, as granulation agent and excipient for tablets, as coating for tablets. In plastics and cellulose industry, in rigid polyurethane foams, manuf of ink and of transparent soaps.

U.S. Exports · 3 items

(1972) 7.06X10+8 G (CANE/BEET, RAW & REFINED)

(1975) 1.87X10+11 G

(1984) 2.79X10+10 g /Sugar cane, beet, crystalline structure or dry amorphous form, refined/

U.S. Imports · 3 items

(1972) 4.77X10+12 G (CANE/BEET SUGAR & SYRUP)

(1975) 3.62X10+12 G

(1984) 3.28X10+12 g /Cane or beet sugars, syrups, molasses, NSPF (Raw Value)/

U.S. Production · 3 items

2023: 250,000 - <550,000 lb

(1972) 5.01X10+13 G (CANE & BEET SUGAR)

(1975) 5.19X10+13 G (CANE AND BEET SUGAR)

Consumption Patterns · 1 item

(DELIVERIES OF REFINED SUGAR): 35% WAS CONSUMED DIRECTLY FOR SWEETENING FOODS & BEVERAGES; THE REMAINING 65% WAS USED INDUSTRIALLY IN BEVERAGES (22%); IN BAKERY & CEREAL PRODUCTS (12%); IN CONFECTIONS (9%); IN CANNED, BOTTLED, & FROZEN FOODS (6%); IN ICE CREAM & DAIRY PRODUCTS (5%); IN MISC FOODS (5%); & IN NON-FOOD & UNSPECIFIED USES (6%) (1976)

Consumer UsesNot Known or Reasonably Ascertainable
Additional notes · 1 item

DefinitionChEBI: Sucrose is a glycosyl glycoside formed by glucose and fructose units joined by an acetal oxygen bridge from hemiacetal of glucose to the hemiketal of the fructose. It has a role as an osmolyte, a sweetening agent, a human metabolite, an algal metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a mouse metabolite.

Related reactions

240 records

Compound notes

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