Cas no 85743-02-8 (2-Amino-4-(methoxycarbonyl)benzoic acid)

2-Amino-4-(methoxycarbonyl)benzoic acid structure
85743-02-8 structure
Product Name:2-Amino-4-(methoxycarbonyl)benzoic acid
CAS No:85743-02-8
MF:C9H9NO4
MW:195.172062635422
MDL:MFCD08690068
CID:708180
PubChem ID:13349386
Update Time:2024-10-26

2-Amino-4-(methoxycarbonyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Amino-4-(methoxycarbonyl)benzoic acid
    • 1,4-Benzenedicarboxylicacid, 2-amino-, 4-methyl ester
    • 2-Amino-4-methoxycarbonyl benzoic acid
    • Methyl 3-Amino-4-carboxybenzoate
    • 2-aminobenzene-1,4-dicarboxylic acid,4-methyl ester
    • 2-aminoterephthalic acid 4-methyl ester
    • amino-terephthalic acid-4-methyl ester
    • Amino-terephthalsaeure-4-methylester
    • 2-AMINO-4-METHOXYCARBONYL BENZOIC ACID
    • 2-amino-4-methoxycarbonylbenzoic acid
    • AK139837
    • 2-Carboxy-5-(methoxycarbonyl)aniline
    • AMBZ0039
    • WOLYDIFKLNALLS-UHFFFAOYSA-N
    • 4-carbomethoxy-2-aminobenzoic acid
    • FCH862446
    • 0855AF
    • SBB053749
    • OR40063
    • 2-Amino-terephthalic acid 4-me
    • 4-Methyl 2-amino-1,4-benzenedicarboxylate (ACI)
    • 2-Amino-terephthalic acid 4-methyl ester
    • AKOS006291523
    • 2-Amino-4-(methoxycarbonyl)benzoicacid
    • 2-AMINO-4-(MEO-CARBONYL)-BENZOIC ACID
    • CS-W006509
    • TS-00293
    • MFCD08690068
    • EN300-214181
    • 85743-02-8
    • SY101805
    • DA-02193
    • DTXSID90537835
    • SCHEMBL1462210
    • MDL: MFCD08690068
    • Inchi: 1S/C9H9NO4/c1-14-9(13)5-2-3-6(8(11)12)7(10)4-5/h2-4H,10H2,1H3,(H,11,12)
    • InChI Key: WOLYDIFKLNALLS-UHFFFAOYSA-N
    • SMILES: O=C(C1C(N)=CC(C(OC)=O)=CC=1)O

Computed Properties

  • Exact Mass: 195.05300
  • Monoisotopic Mass: 195.05315777g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 241
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 89.6

Experimental Properties

  • Color/Form: No data available
  • Density: 1.4±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 397.7±32.0 °C at 760 mmHg
  • Flash Point: 194.3±25.1 °C
  • PSA: 89.62000
  • LogP: 1.33480

2-Amino-4-(methoxycarbonyl)benzoic acid Security Information

2-Amino-4-(methoxycarbonyl)benzoic acid Customs Data

  • HS CODE:2922509090
  • Customs Data:

    China Customs Code:

    2922509090

    Overview:

    2922509090. Other amino alcohol phenols\Amino acid phenols and other oxygenated amino compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food

    Summary:

    2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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2-Amino-4-(methoxycarbonyl)benzoic acid Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Chlorotrimethylsilane Solvents: Methanol ;  14 h, 65 - 70 °C; 70 °C → rt
1.2 Reagents: Potassium carbonate
Reference
A biotin-conjugated pyridine-based isatoic anhydride, a selective room temperature RNA-acylating agent for the nucleic acid separation
Ursuegui, S.; et al, Organic & Biomolecular Chemistry, 2015, 13(12), 3625-3632

Production Method 2

Reaction Conditions
1.1 Reagents: Chlorotrimethylsilane Solvents: Methanol ;  15 h, reflux
1.2 Reagents: Sodium bicarbonate Solvents: Water
Reference
Syntheses of o-iodobenzyl alcohols-BODIPY structures as potential precursors of bimodal tags for positron emission tomography and optical imaging
Christine, Thifanie; et al, Tetrahedron, 2019, 75(52),

Production Method 3

Reaction Conditions
Reference
New derivatives of pyrrolo and pyrido[2,1-b]quinazoline as antiulcer agents
Doria, G.; et al, Farmaco, 1984, 39(11), 968-78

2-Amino-4-(methoxycarbonyl)benzoic acid Raw materials

2-Amino-4-(methoxycarbonyl)benzoic acid Preparation Products

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