1,4-Dioxane-2,3-diol - ≥96% , CAS No.4845-50-5

CAS: 4845-50-5 Cat. No.: D154497 Molecular Weight: 120.1 Beilstein Registry Number: 1(4)3627 EC Number: 225-431-3
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
STR04115 | 1,4-Dioxane-2,3-diol | 1,4dioxane-2,3-diol | MFCD06795925 | NSC57544 | FT-0606898 | DTXCID9018824 | F0001-1270 | STL558621 | EINECS 225-431-3 | 2,3-Dihydroxy-1,4-dioxane | 3PYY0W5672 | NCGC00255657-01 | Dioxanediol | EN300-7113635 | UNII-3PYY0W
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
D154497-1g
9

$12.90

$19.90
Save $7.00 (35.18%)
5g
D154497-5g
1

$43.90

$65.90
Save $22.00 (33.38%)
10g
D154497-10g
2

$79.90

$119.90
Save $40.00 (33.36%)
25g
D154497-25g
2

$150.90

$226.90
Save $76.00 (33.49%)
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🧪

Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
STR04115 | 1, 4-Dioxane-2, 3-diol | 1, 4dioxane-2, 3-diol | MFCD06795925 | NSC57544 | FT-0606898 | DTXCID9018824 | F0001-1270 | STL558621 | EINECS 225-431-3 | 2, 3-Dihydroxy-1, 4-dioxane | 3PYY0W5672 | NCGC00255657-01 | Dioxanediol | EN300-7113635 | UNII-3PYY0W
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Purity
≥96%
Names and Identifiers
Pubchem Sid488186974
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186974
Canonical SmilesC1COC(C(O1)O)O
IUPAC Name1,4-dioxane-2,3-diol
InChIKeyYLVACWCCJCZITJ-UHFFFAOYSA-N
INCHI1S/C4H8O4/c5-3-4(6)8-2-1-7-3/h3-6H,1-2H2
Isomeric SMILES C1COC(C(O1)O)O
Molecular Weight 120.1
Beilstein 1(4)3627
Reaxy-Rn 104209
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=104209&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDioxanes
Subclass1,4-dioxanes
Intermediate Tree Nodes Not available
Direct Parent1,4-dioxanes
Alternative Parents Hemiacetals  Oxacyclic compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Para-dioxane - Hemiacetal - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 1,4-dioxanes. These are organic compounds containing 1,4-dioxane, an aliphatic six-member ring with two oxygen atoms in ring positions 1 and 4.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot NumberCertificate TypeDateItem
A2419310Certificate of AnalysisJan 25, 2024 D154497
A2419311Certificate of AnalysisJan 25, 2024 D154497
A2419312Certificate of AnalysisJan 25, 2024 D154497
A2419313Certificate of AnalysisJan 25, 2024 D154497
D23061208Certificate of AnalysisDec 07, 2022 D154497
K2228172Certificate of AnalysisDec 07, 2022 D154497
K2228173Certificate of AnalysisDec 07, 2022 D154497
K2228174Certificate of AnalysisDec 07, 2022 D154497
K2228177Certificate of AnalysisDec 07, 2022 D154497
Chemical and Physical Properties
SolubilitySoluble in Methanol
Melt Point(°C)114 °C
Molecular Weight120.100 g/mol
XLogP3-1.300
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass120.042 Da
Monoisotopic Mass120.042 Da
Topological Polar Surface Area58.900 Ų
Heavy Atom Count8
Formal Charge0
Complexity64.400
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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