5-(2-Phenylethyl)-1,3,4-thiadiazol-2-amine - ≥97% , CAS No.39181-40-3

CAS: 39181-40-3 Cat. No.: P1369426 Molecular Weight: 205.28
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Storage
Store at 2-8°C,Protected from light
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
P1369426-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$15.90
250mg
P1369426-250mg
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$47.90
1g
P1369426-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$114.90
5g
P1369426-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$361.90
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light Ships Wet ice 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

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.
Purity
≥97%
Names and Identifiers
Canonical SmilesC1=CC=C(C=C1)CCC2=NN=C(S2)N
IUPAC Name5-(2-phenylethyl)-1,3,4-thiadiazol-2-amine
InChIKeyHSTFNSVDVOLQQH-UHFFFAOYSA-N
INCHI1S/C10H11N3S/c11-10-13-12-9(14-10)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,13)
Isomeric SMILES C1=CC=C(C=C1)CCC2=NN=C(S2)N
Molecular Weight 205.28

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

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassThiadiazoles
Intermediate Tree Nodes Aminothiadiazoles - 2-amino-1,3,4-thiadiazoles
Direct Parent2-amino-5-substituted-1,3,4-thiadiazoles
Alternative Parents Benzene and substituted derivatives  Heteroaromatic compounds  Azacyclic compounds  Primary amines  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 2-amino-5-substituted-1,3,4-thiadiazole - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 2-amino-5-substituted-1,3,4-thiadiazoles. These are thiadiazoles with an amino group attached to the 2-position of a 1,3,4-thiadiazole ring, as well as a substituent at the 5-position.
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.

4 results found

Lot NumberCertificate TypeDateItem
K2517679Certificate of AnalysisSep 22, 2025 P1369426
K2517680Certificate of AnalysisSep 22, 2025 P1369426
K2517681Certificate of AnalysisSep 22, 2025 P1369426
K2517753Certificate of AnalysisSep 22, 2025 P1369426
Chemical and Physical Properties
Sensitivitylight & Moisture sensitive
Molecular Weight205.280 g/mol
XLogP32.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass205.067 Da
Monoisotopic Mass205.067 Da
Topological Polar Surface Area80.000 Ų
Heavy Atom Count14
Formal Charge0
Complexity171.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
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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