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isosorbide
1,4:3,6-dianhydro-D-glucitol

Supplier Sponsors

Name:(3S,3aR,6R,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
CAS Number: 652-67-5Picture of molecule3D/inchi
Other(deleted CASRN):151380-60-8
ECHA EINECS - REACH Pre-Reg:211-492-3
FDA UNII: WXR179L51S
Nikkaji Web:J7.077G
Beilstein Number:0080510
MDL:MFCD00064827
XlogP3:-1.40 (est)
Molecular Weight:146.14250000
Formula:C6 H10 O4
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:indirect food additives: adhesives and components of coatings
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
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Google Patents:Search
US Patents:Search
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Pubchem Patents:Search
PubMed:Search
NCBI:Search
DG SANTE Food Contact Materials:1,4:3,6-dianhydro-D-glucitol
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 62.50 °C. @ 760.00 mm Hg
Boiling Point: 372.05 °C. @ 760.00 mm Hg (est)
Flash Point: 354.00 °F. TCC ( 178.80 °C. ) (est)
logP (o/w): -1.194 (est)
Soluble in:
 water, 4.714e+005 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Isosorbide
Carbosynth
For experimental / research use only.
1,4:3,6-Dianhydro-D-glucitol
Sigma-Aldrich: Aldrich
For experimental / research use only.
Dianhydro-D-glucitol 98%
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
intraperitoneal-mouse LD50 13600 mg/kg
Drugs in Japan Vol. 6, Pg. 71, 1982.

intravenous-mouse LD50 6870 mg/kg
BRAIN AND COVERINGS: CHANGES IN CEREBRAL SPINAL FLUID
Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 15, 1969.

oral-mouse LD50 289 mg/kg
Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 187, 1969.

intravenous-rat LD50 11000 mg/kg
Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 64(4), Pg. 158S, 1968.

oral-rat LD50 24150 mg/kg
Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 15, 1969.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
indirect food additives: adhesives and components of coatings
Recommendation for isosorbide usage levels up to:
 not for fragrance use.
 
Recommendation for isosorbide flavor usage levels up to:
 not for flavor use.
 
Safety References:
European Food Safety Authority (EFSA) reference(s):

Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to a 15th list of substances for food contact materials
View page or View pdf

Scientific Opinion on the safety evaluation of the substance, 1,4:3,6-dianhydrosorbitol, CAS No 652-67-5, for use in food contact materials
View page or View pdf

EPI System: View
ClinicalTrials.gov:search
Daily Med:search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):652-67-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12597
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(3S,3aR,6R,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
Chemidplus:0000652675
RTECS:LZ4380000 for cas# 652-67-5
 
References:
 (3S,3aR,6R,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:652-67-5
Pubchem (cid):12597
Pubchem (sid):134977138
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Indirect Additives used in Food Contact Substances:View
CHEMBL:View
Golm Metabolome Database:Search
KEGG (GenomeNet):D00347
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2932.90.5000
MedlinePlusSupp:View
ChemSpider:View
Wikipedia:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report
Formulations/Preparations:
ismotic (alcon), oral as 45% solution.
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 devicoran
1,4:3,6-dianhydro-D-glucitol
1,4:3,6-dianhydro-dextro-glucitol
D-1,4:3,6-dianhydroglucitol
1,4-dianhydrosorbitol
D-glucitol, 1,4:3,6-dianhydro-
 glucitol, 1,4:3,6-dianhydro-, D-
(3S,3aR,6R,6aR)-hexahydro-furo[3,2-b]furan-3,6-diol
(3R,3aR,6S,6aR)-hexahydrofuro[3,2-b]furan-3,6-diol
(3S,3aR,6R,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
(3R,3aR,6S,6aR)-hexahydrofuro[3,2-b]furane-3,6-diol
 hydronol
 ismotic
(+)-D-isosorbide
isosorbidum
 
 
Notes:
1,4:3,6-dianhydro d-glucitol. chemically inert osmotic diuretic used mainly to treat hydrocephalus; also used in glaucoma.
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