2-(1-Pyrazolyl)benzylamine - ≥95% , CAS No.449758-13-8

CAS: 449758-13-8 Cat. No.: B710053 Molecular Weight: 173.22 EC Number: 640-682-2 PubChem CID: 7015036
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
1-[2-(1H-Pyrazol-1-yl)phenyl]methanamine | 2-(1H-Pyrazol-1-yl)benzylamine
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
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Size
Status
Price
Qty
250mg
B710053-250mg
1
$59.90
1g
B710053-1g
1

$114.90

$169.90
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5g
B710053-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$507.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged 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

Synonyms
1-[2-(1H-Pyrazol-1-yl)phenyl]methanamine | 2-(1H-Pyrazol-1-yl)benzylamine
Specifications & Purity
≥95%
Storage
Store at 2-8°C, Protected from light, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Canonical SmilesC1=CC=C(C(=C1)CN)N2C=CC=N2
IUPAC Name(2-pyrazol-1-ylphenyl)methanamine
InChIKeySJMJUZRSTJBVPG-UHFFFAOYSA-N
INCHI1S/C10H11N3/c11-8-9-4-1-2-5-10(9)13-7-3-6-12-13/h1-7H,8,11H2
Isomeric SMILES C1=CC=C(C(=C1)CN)N2C=CC=N2
PubChem CID 7015036
Molecular Weight 173.22

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
SubclassPyrazoles
Intermediate Tree Nodes Not available
Direct ParentPhenylpyrazoles
Alternative Parents Phenylmethylamines  Benzylamines  Aralkylamines  Heteroaromatic compounds  Azacyclic compounds  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Phenylpyrazole - Phenylmethylamine - Benzylamine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Pseudomonas aeruginosa (123386 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
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.

6 results found

Lot NumberCertificate TypeDateItem
G2518243Certificate of AnalysisFeb 17, 2025 B710053
G2518244Certificate of AnalysisFeb 17, 2025 B710053
G2518245Certificate of AnalysisFeb 17, 2025 B710053
G2518246Certificate of AnalysisFeb 17, 2025 B710053
G2518247Certificate of AnalysisFeb 17, 2025 B710053
G2518248Certificate of AnalysisFeb 17, 2025 B710053
Chemical and Physical Properties
Sensitivitylight sensitive
Molecular Weight173.210 g/mol
XLogP30.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass173.095 Da
Monoisotopic Mass173.095 Da
Topological Polar Surface Area43.800 Ų
Heavy Atom Count13
Formal Charge0
Complexity160.000
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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