Cas no 70978-07-3 (Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate)

Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate structure
70978-07-3 structure
Product Name:Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate
CAS No:70978-07-3
MF:C9H11NO3
MW:181.188542604446
CID:1027199
PubChem ID:12571289
Update Time:2025-04-20

Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate
    • Methyl 3-amino-2-hydroxy-5-methylbenzoate 95+
    • ANW-55404
    • CTK5D3281
    • Methyl-3-amino-2-hydroxy-5-methyl-benzoat
    • SBB089788
    • FT-0681721
    • DTXSID60502979
    • Methyl3-amino-2-hydroxy-5-methylbenzoate
    • Benzoic acid, 3-amino-2-hydroxy-5-methyl-, methyl ester
    • Methyl 3-amino-2-hydroxy-5-methylbenzoate, AldrichCPR
    • 70978-07-3
    • METHYL 3-AMINO-2-HYDROXY-5-METHYLBENZOATE 95+%
    • MFCD14560550
    • SCHEMBL11071838
    • AKOS005073750
    • VCA97807
    • CS-0326574
    • Methyl 3-amino-2-hydroxy-5-methylbenzoate
    • A866514
    • ND-0035
    • J-522127
    • MDL: MFCD14560550
    • Inchi: 1S/C9H11NO3/c1-5-3-6(9(12)13-2)8(11)7(10)4-5/h3-4,11H,10H2,1-2H3
    • InChI Key: BYDBTYDCQJZXAT-UHFFFAOYSA-N
    • SMILES: OC1C(=CC(C)=CC=1C(=O)OC)N

Computed Properties

  • Exact Mass: 181.07393
  • Monoisotopic Mass: 181.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 195
  • 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: 1.7
  • Topological Polar Surface Area: 72.6?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 295.7±40.0 °C at 760 mmHg
  • Flash Point: 132.7±27.3 °C
  • PSA: 72.55
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

Methyl 3-amino-2-hydroxy-5-methylbenzenecarboxylate Security Information

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