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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Bromo-3-methylbenzene-1,2-diamine - ≥97% , CAS No.952511-74-9
Synonyms
A857457 | JBZQNBSYFRCDRA-UHFFFAOYSA-N | O11183 | 4-bromo-3-methyl-benzene-1,2-diamine | 4-Bromo-3-methylbenzene-1,2-diamine | DTXSID90731275 | SY104514 | DS-3539 | 4-Bromo-3-methyl-1,2-benzenediamine | SCHEMBL145182 | CNB51174 | MFCD18642364 | EN300-29806
Storage
Store at 2-8°C,Protected from light
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Protected from light Ships Wet ice 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
A857457 | JBZQNBSYFRCDRA-UHFFFAOYSA-N | O11183 | 4-bromo-3-methyl-benzene-1, 2-diamine | 4-Bromo-3-methylbenzene-1, 2-diamine | DTXSID90731275 | SY104514 | DS-3539 | 4-Bromo-3-methyl-1, 2-benzenediamine | SCHEMBL145182 | CNB51174 | MFCD18642364 | EN300-29806
Specifications & Purity
≥97%
Storage
Store at 2-8°C, Protected from light
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CC1=C(C=CC(=C1N)N)Br IUPAC Name 4-bromo-3-methylbenzene-1,2-diamine InChIKey JBZQNBSYFRCDRA-UHFFFAOYSA-N INCHI 1S/C7H9BrN2/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,9-10H2,1H3 Isomeric SMILES CC1=C(C=CC(=C1N)N)Br Molecular Weight 201.06 Reaxy-Rn 18702169 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18702169&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 Benzenoids Class Benzene and substituted derivatives Subclass Toluenes Intermediate Tree Nodes Aminotoluenes Direct Parent Diaminotoluenes Alternative Parents Aniline and substituted anilines Bromobenzenes Aryl bromides Primary amines Organobromides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Diaminotoluene - Aniline or substituted anilines - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as diaminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group exactly 2 amino groups. 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 201.060 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 199.995 Da Monoisotopic Mass 199.995 Da Topological Polar Surface Area 52.000 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 118.000 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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