4-(3-aminophenyl)-1-methyl-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid - ≥97% , CAS No.1354706-25-4

CAS: 1354706-25-4 Cat. No.: A958037 Molecular Weight: 268.270
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
A958037-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$638.90
100mg
A958037-100mg
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$809.90
250mg
A958037-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,033.90
500mg
A958037-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,458.90
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships 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
Room temperature
Purity
≥97%
Names and Identifiers
Canonical SmilesCN1C2=NC=CC(=C2C(=N1)C(=O)O)C3=CC(=CC=C3)N
IUPAC Name4-(3-aminophenyl)-1-methylpyrazolo[3,4-b]pyridine-3-carboxylic acid
InChIKeyYLQHTJWHBAWPOO-UHFFFAOYSA-N
INCHI1S/C14H12N4O2/c1-18-13-11(12(17-18)14(19)20)10(5-6-16-13)8-3-2-4-9(15)7-8/h2-7H,15H2,1H3,(H,19,20)
Molecular Weight 268.270

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
ClassPyridines and derivatives
SubclassPhenylpyridines
Intermediate Tree Nodes Not available
Direct ParentPhenylpyridines
Alternative Parents Pyrazolopyridines  Pyrazole carboxylic acids and derivatives  Aniline and substituted anilines  Heteroaromatic compounds  Amino acids  Carboxylic acids  Azacyclic compounds  Primary amines  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 4-phenylpyridine - Pyrazolopyridine - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic oxide - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
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 Weight268.270 g/mol
XLogP31.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass268.096 Da
Monoisotopic Mass268.096 Da
Topological Polar Surface Area94.000 Ų
Heavy Atom Count20
Formal Charge0
Complexity378.000
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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