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· · COA & SDS available for every product · Same-day shipping on in-stock items (±)-1,2,4-Butanetriol - ≥98% , CAS No.3068-00-6
Synonyms
1,4-Butanetriol | 2-01-00-00596 (Beilstein Handbook Reference) | NSC60197 | NSC-60197 | NK798C370H | CAS-3068-00-6 | Triol 124 | 1,2,4-Butantriol | 1,2,4-BUTANETRIOL | EINECS 221-323-5 | A637710B-C321-4E3F-A354-64FC18733531 | B0687 | 2-Deoxyerythritol | F
Storage
Argon charged,Room temperature
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
1, 4-Butanetriol | 2-01-00-00596 (Beilstein Handbook Reference) | NSC60197 | NSC-60197 | NK798C370H | CAS-3068-00-6 | Triol 124 | 1, 2, 4-Butantriol | 1, 2, 4-BUTANETRIOL | EINECS 221-323-5 | A637710B-C321-4E3F-A354-64FC18733531 | B0687 | 2-Deoxyerythritol | F
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Names and Identifiers Pubchem Sid 504752876 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504752876 Canonical Smiles C(CO)C(CO)O IUPAC Name butane-1,2,4-triol InChIKey ARXKVVRQIIOZGF-UHFFFAOYSA-N INCHI 1S/C4H10O3/c5-2-1-4(7)3-6/h4-7H,1-3H2 Isomeric SMILES C(CO)C(CO)O WGK Germany 1 RTECS EK7176000 Molecular Weight 106.12 Beilstein 1733456 Reaxy-Rn 1719409 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719409&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.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic oxygen compounds Class Organooxygen compounds Subclass Alcohols and polyols Intermediate Tree Nodes Not available Direct Parent Secondary alcohols Alternative Parents Polyols Primary alcohols Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Secondary alcohol - Polyol - Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Moisture sensitive. Refractive Index 1.4738-1.4758 Flash Point(°F) 188°(370°F) Flash Point(°C) 188°(370°F) Boil Point(°C) 190-191°C Melt Point(°C) -20°C Molecular Weight 106.120 g/mol XLogP3 -1.400 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 106.063 Da Monoisotopic Mass 106.063 Da Topological Polar Surface Area 60.700 Ų Heavy Atom Count 7 Formal Charge 0 Complexity 37.900 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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