3-MFA - ≥97%(HPLC) , CAS No.16524-22-4

CAS: 16524-22-4 Cat. No.: M167761 Molecular Weight: 227.26 EC Number: 803-178-5
AVAILABLE TO ORDER
GRADE & PURITY ≥97%(HPLC)
Synonyms
16524-22-4|2-(m-Tolylamino)benzoic acid|N-(3-Methylphenyl)anthranilic acid|2-(3-methylanilino)benzoic acid|Benzoic acid, 2-[(3-methylphenyl)amino]-|Anthranilic acid, N-(m-tolyl)-|2-m-Tolylamino-benzoic acid|2-(3-toluidino)benzoic acid|CHEMBL23479|Benzoic
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5mg
M167761-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$230.90

$269.90
Save $39.00 (14.45%)
25mg
M167761-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$931.90

$1,087.90
Save $156.00 (14.34%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥97%(HPLC) 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.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
16524-22-4 | 2-(m-Tolylamino)benzoic acid | N-(3-Methylphenyl)anthranilic acid | 2-(3-methylanilino)benzoic acid | Benzoic acid, 2-[(3-methylphenyl)amino]- | Anthranilic acid, N-(m-tolyl)- | 2-m-Tolylamino-benzoic acid | 2-(3-toluidino)benzoic acid | CHEMBL23479 | Benzoic
Specifications & Purity
≥97%(HPLC)
Storage
Room temperature
Shipped In
Normal
Purity
≥97%(HPLC)
Names and Identifiers
Canonical SmilesCC1=CC(=CC=C1)NC2=CC=CC=C2C(=O)O
IUPAC Name2-(3-methylanilino)benzoic acid
InChIKeyJODCQKTVDXZQEP-UHFFFAOYSA-N
INCHI1S/C14H13NO2/c1-10-5-4-6-11(9-10)15-13-8-3-2-7-12(13)14(16)17/h2-9,15H,1H3,(H,16,17)
Isomeric SMILES CC1=CC(=CC=C1)NC2=CC=CC=C2C(=O)O
WGK Germany 3
Molecular Weight 227.26
Reaxy-Rn 2214283
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2214283&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

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Aminobenzoic acids and derivatives
Direct ParentAminobenzoic acids
Alternative Parents Benzoic acids  Benzoyl derivatives  Aniline and substituted anilines  Aminotoluenes  Vinylogous amides  Amino acids  Secondary amines  Monocarboxylic acids and derivatives  Carboxylic acids  Organopnictogen compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aminobenzoic acid - Benzoic acid - Benzoyl - Aminotoluene - Aniline or substituted anilines - Toluene - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
AKR1C2 Tchem Aldo-keto reductase family 1 member C2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
AKR1C3 Tchem Aldo-keto reductase family 1 member C3 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
AKR1C3 Tchem Aldo-keto-reductase family 1 member C3 (1414 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AKR1C2 Tchem Aldo-keto reductase family 1 member C2 (639 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
H4 (48 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:
Chemical and Physical Properties
Molecular Weight227.260 g/mol
XLogP34.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass227.095 Da
Monoisotopic Mass227.095 Da
Topological Polar Surface Area49.300 Ų
Heavy Atom Count17
Formal Charge0
Complexity267.000
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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