3-(propan-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine - ≥97% , CAS No.952182-05-7

CAS: 952182-05-7 Cat. No.: P178480 Molecular Weight: 166.228 EC Number: 974-577-0 PubChem CID: 52911275
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
AKOS011877755 | DTXSID80680586 | FT-0684626 | J-512727 | PB17639 | SY042110 | CNB18205 | HLVMFESFZBIMBC-UHFFFAOYSA-N | 3-Isopropyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine | 3-isopropyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]-pyrazine | AM201203
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
P178480-1g
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$307.90

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Why this grade

≥97% 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
AKOS011877755 | DTXSID80680586 | FT-0684626 | J-512727 | PB17639 | SY042110 | CNB18205 | HLVMFESFZBIMBC-UHFFFAOYSA-N | 3-Isopropyl-5, 6, 7, 8-tetrahydro-[1, 2, 4]triazolo[4, 3-a]pyrazine | 3-isopropyl-5, 6, 7, 8-tetrahydro[1, 2, 4]triazolo[4, 3-a]-pyrazine | AM201203
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesCC(C)C1=NN=C2N1CCNC2
IUPAC Name3-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
InChIKeyHLVMFESFZBIMBC-UHFFFAOYSA-N
INCHI1S/C8H14N4/c1-6(2)8-11-10-7-5-9-3-4-12(7)8/h6,9H,3-5H2,1-2H3
Isomeric SMILES CC(C)C1=NN=C2N1CCNC2
PubChem CID 52911275
Molecular Weight 166.228

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassTriazolopyrazines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentTriazolopyrazines
Alternative Parents Aralkylamines  Pyrazines  Triazoles  Heteroaromatic compounds  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Triazolopyrazine - Aralkylamine - Pyrazine - Azole - Triazole - 1,2,4-triazole - Heteroaromatic compound - Secondary amine - Azacycle - Secondary aliphatic amine - Amine - Organic nitrogen compound - Organonitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as triazolopyrazines. These are compounds containing a triazole ring fused to a pyrazine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyrazine is a 6-membered ring consisting of six carbon atoms and two nitrogen centers at ring positions 1 and 4.
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:
Chemical and Physical Properties
Molecular Weight166.220 g/mol
XLogP3-0.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass166.122 Da
Monoisotopic Mass166.122 Da
Topological Polar Surface Area42.700 Ų
Heavy Atom Count12
Formal Charge0
Complexity159.000
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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