Glucochloralose
Basic information
- CAS
15879-93-3- Standard SMILES
OCC(O)C1OC2OC(C(Cl)(Cl)Cl)OC2C1O- InChIKey
OJYGBLRPYBAHRT-UHFFFAOYSA-N- Molecular formula
- C8H11Cl3O6
- Average molar mass
- 309.5 g/mol
- Monoisotopic mass
- 307.962121
Overview
See also: Chloralose (annotation moved to).
Names & identifiers
- Preferred name
- Glucochloralose
- IUPAC
- 1-[6-hydroxy-2-(trichloromethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol
- English name
- α-Chloralose
- Molecular formula
- C8H11Cl3O6
- Molecular weight
- 309.53
Names & synonyms
Glucochloralosealpha-ChloraloseChloralose, .beta.-1190922-48-5Chloralose-alpha1-[6-hydroxy-2-(trichloromethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol1-(6-Hydroxy-2-(trichloromethyl)tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)ethane-1,2-diolC8H11Cl3O6Chlorlose-alpha1-[6-hydroxy-2-(trichloromethyl)-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol1,2-O-(2,2,2-Trichloroethylidene)hexofuranose1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose
Show more names
murexsomioalfamataphosalS-17086dulcidoralphakilkrakalosALFA-4(R)
a-Formalpha-Chloralose 98%alpha-Chloralose (AM)starbld0022721Anhydro-D -glucochloralalpha-CHLORALOSE, REAGSCHEMBL39186OJYGBLRPYBAHRT-UHFFFAOYSA-
Database identifiers
- CAS
15879-93-3、16376-36-6- PubChem CID
- 85991
- DTXSID
DTXSID70860173
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 88.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 285
Experimental & physicochemical properties
LogP1.02
Solubility4.44 mg/mL at 15 °C
Melting Point187 °C
Physical DescriptionSolid
Physicochemical properties
- Melting point
- 178 · 178-182 °C
- alpha
- 18 · 18 º (c=2, 95% C2H5OH)
- Boiling point
- 424.33 °C · 424.33°C (rough estimate)
- Density
- 1.6066 · 1.6066 (rough estimate)
- vapor pressure
- Negligible at room temperature
- refractive index
- 1.532 · 1.5320 (estimate)
- solubility
- 10 mg/mL · ethanol: 10 mg/mL or yellow-brown, clear to slightly hazy, colorless to faintly yellow
- pka
- 12.89 · 12.89±0.60(Predicted)
- form
- Solid
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- FM9450000
- ridadr
- 3249
- hs_code
- 29400090
- Toxicity
- LD50 orally in mice: 400 mg/kg (Schafer)
- risk_code
- 20/22-20/21/22
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS09
- hazard_code
- Xn
- safety_code
- 16-24/25-28-28A-36
- hazard_class
- 6.1(b)
- Storage Class
- 6.1D - Non-combustible acute toxic Cat.3toxic hazardous materials or hazardous materials causing chronic effects
- packing_group
- III
- target organs
- Central nervous system
- Hazard statements
- H300-H332-H336-H410
- Hazard Classifications
- Acute Tox. 3 OralAcute Tox. 4 InhalationAquatic Acute 1Aquatic Chronic 1STOT SE 3
- Precautionary statements
- P501-P261-P273-P270-P271-P264-P391-P301+P310+P330-P304+P340+P312-P403+P233-P405
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Applications
DescriptionChloralose, (R)-1,2-O-(2,2,2-trichloroethylidene)- α-D-glucofuranose, is a crystalline powder which is soluble in water, fairly soluble in alcohol, diethyl ether, glacial acetic acid, sparingly soluble in chloroform, practically insoluble in petroleum ether.Chloralose is produced by reaction of glucose with waterfree chloral under heating (21).
UsesCoating seeds to protect them from birds.
UsesIt has been employed widely as an animal anesthetic in the laboratory setting. alpha-chloralose is a true anesthetic or an immobilizing agent with sedative-hypnotic properties has important implications. Canada geese (Branta canadensis) and blue geese (Chen caerulescens) were caught with alpha-chloralose, an oral hypnotic administered on bait. Wild turkeys (Meleagris gallopavo) were captured with alpha-chloralose, an oral anesthetic.
UsesChloralose is used for the control of rodents, particularly mice, and as a bird repellent and a bird narcotic.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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