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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,3,5-Triazine-2,4-diamine, 1-(3-chlorophenyl)-1,6-dihydro-6,6-dimethyl- , CAS No.13351-02-5
Synonyms
1-(3-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine | X 48 | 47GU3ESV2R | 1,3,5-Triazine-2,4-diamine, 1-(3-chlorophenyl)-1,6-dihydro-6,6-dimethyl- | D 69 | NSC 3080 | UNII-47GU3ESV2R | 1-(3-chlorophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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-(3-chlorophenyl)-6, 6-dimethyl-1, 3, 5-triazine-2, 4-diamine | X 48 | 47GU3ESV2R | 1, 3, 5-Triazine-2, 4-diamine, 1-(3-chlorophenyl)-1, 6-dihydro-6, 6-dimethyl- | D 69 | NSC 3080 | UNII-47GU3ESV2R | 1-(3-chlorophenyl)-6, 6-dimethyl-1, 6-dihydro-1, 3, 5-triazine-2, 4-
Product Properties Names and Identifiers Canonical Smiles CC1(N=C(N=C(N1C2=CC(=CC=C2)Cl)N)N)C IUPAC Name 1-(3-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine InChIKey AXIUXECRTOGILY-UHFFFAOYSA-N INCHI 1S/C11H14ClN5/c1-11(2)16-9(13)15-10(14)17(11)8-5-3-4-7(12)6-8/h3-6H,1-2H3,(H4,13,14,15,16) Isomeric SMILES CC1(N=C(N=C(N1C2=CC(=CC=C2)Cl)N)N)C Molecular Weight 251.71 Reaxy-Rn 229695 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=229695&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 Organoheterocyclic compounds Class Triazines Subclass Aminotriazines Intermediate Tree Nodes Not available Direct Parent Aminotriazines Alternative Parents Chlorobenzenes Aryl chlorides 1,3,5-triazines Guanidines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Organochlorides Imines Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Aminotriazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,3,5-triazine - Benzenoid - Guanidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Imine - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as aminotriazines. These are organic compounds containing an amino group attached to a triazine ring. 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) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 251.710 g/mol XLogP3 0.700 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 1 Exact Mass 251.094 Da Monoisotopic Mass 251.094 Da Topological Polar Surface Area 80.000 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 363.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 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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