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· · COA & SDS available for every product · Same-day shipping on in-stock items 5-(4-Isopropylphenyl)-1,3,4-Thiadiazol-2-Amine - ≥95% , CAS No.100987-89-1
Synonyms
SCHEMBL10022384 | AKOS000225579 | BIM-0010068.P001 | MFCD02032690 | EN300-12632 | SR-01000227276-1 | 1,3,4-Thiadiazol-2-amine, 5-[4-(1-methylethyl)phenyl]- | HMS1780L22 | Oprea1_728717 | Z85923448 | CB13012 | DTXSID00358174 | CBMicro_010096 | 5-(4-isoprop
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Why this grade ≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping 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
SCHEMBL10022384 | AKOS000225579 | BIM-0010068.P001 | MFCD02032690 | EN300-12632 | SR-01000227276-1 | 1, 3, 4-Thiadiazol-2-amine, 5-[4-(1-methylethyl)phenyl]- | HMS1780L22 | Oprea1_728717 | Z85923448 | CB13012 | DTXSID00358174 | CBMicro_010096 | 5-(4-isoprop
Specifications & Purity
≥95%
Names and Identifiers Canonical Smiles CC(C)C1=CC=C(C=C1)C2=NN=C(S2)N IUPAC Name 5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-amine InChIKey QEKWMJDRQOKJJS-UHFFFAOYSA-N INCHI 1S/C11H13N3S/c1-7(2)8-3-5-9(6-4-8)10-13-14-11(12)15-10/h3-7H,1-2H3,(H2,12,14) Isomeric SMILES CC(C)C1=CC=C(C=C1)C2=NN=C(S2)N Molecular Weight 219.3 Reaxy-Rn 5429888 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5429888&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 Lipids and lipid-like molecules Class Prenol lipids Subclass Monoterpenoids Intermediate Tree Nodes Not available Direct Parent Aromatic monoterpenoids Alternative Parents Monocyclic monoterpenoids Phenylpropanes Cumenes 2-amino-5-substituted-1,3,4-thiadiazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Cumene - Phenylpropane - 2-amino-5-substituted-1,3,4-thiadiazole - Benzenoid - Monocyclic benzene moiety - 2-amino-1,3,4-thiadiazole - Thiadiazole - Heteroaromatic compound - Azole - Organoheterocyclic compound - Azacycle - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic 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 219.310 g/mol XLogP3 2.800 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 219.083 Da Monoisotopic Mass 219.083 Da Topological Polar Surface Area 80.000 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 202.000 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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