2-Anilinobenzoic acid methyl ester - ≥98% , CAS No.35708-19-1

CAS: 35708-19-1 Cat. No.: A192970 Molecular Weight: 227.26
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
MFCD01366532 | o-Diphenylaminecarboxylic acid methyl ester | methyl 2-(phenylamino)benzoate | SY121370 | C74839 | 2-Anilinobenzoic acid methyl ester | DS-8369 | HMS2379H09 | Methyl 2-anilinobenzoate # | SR-01000403900-1 | Benzoic acid, 2-(phenylamino)-, m
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
A192970-100mg
3

$18.90

$28.90
Save $10.00 (34.60%)
250mg
A192970-250mg
3

$25.90

$38.90
Save $13.00 (33.42%)
1g
A192970-1g
3

$56.90

$85.90
Save $29.00 (33.76%)
5g
A192970-5g
2

$207.90

$311.90
Save $104.00 (33.34%)
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Why this grade

≥98% 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
MFCD01366532 | o-Diphenylaminecarboxylic acid methyl ester | methyl 2-(phenylamino)benzoate | SY121370 | C74839 | 2-Anilinobenzoic acid methyl ester | DS-8369 | HMS2379H09 | Methyl 2-anilinobenzoate # | SR-01000403900-1 | Benzoic acid, 2-(phenylamino)-, m
Specifications & Purity
≥98%
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
≥98%
Names and Identifiers
Canonical SmilesCOC(=O)C1=CC=CC=C1NC2=CC=CC=C2
IUPAC Namemethyl 2-anilinobenzoate
InChIKeyODDHBYXHXZCAGQ-UHFFFAOYSA-N
INCHI1S/C14H13NO2/c1-17-14(16)12-9-5-6-10-13(12)15-11-7-3-2-4-8-11/h2-10,15H,1H3
Isomeric SMILES COC(=O)C1=CC=CC=C1NC2=CC=CC=C2
Molecular Weight 227.26
Reaxy-Rn 2115691
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2115691&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 Not available
Direct ParentBenzoic acid esters
Alternative Parents Aminobenzoic acids and derivatives  Benzoyl derivatives  Aniline and substituted anilines  Vinylogous amides  Methyl esters  Amino acids and derivatives  Secondary amines  Monocarboxylic acids and derivatives  Organopnictogen compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aminobenzoic acid or derivatives - Benzoate ester - Benzoyl - Aniline or substituted anilines - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary amine - Monocarboxylic acid or derivatives - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ALOX15 Tchem Arachidonate 15-lipoxygenase (7108 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B (56204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mapt Microtubule-associated protein tau (6 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.

4 results found

Lot NumberCertificate TypeDateItem
J2330150Certificate of AnalysisOct 16, 2023 A192970
J2330151Certificate of AnalysisOct 16, 2023 A192970
J2330152Certificate of AnalysisOct 16, 2023 A192970
J2330153Certificate of AnalysisOct 16, 2023 A192970
Chemical and Physical Properties
SensitivityLight sensitive
Molecular Weight227.260 g/mol
XLogP34.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass227.095 Da
Monoisotopic Mass227.095 Da
Topological Polar Surface Area38.300 Ų
Heavy Atom Count17
Formal Charge0
Complexity249.000
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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