Cas no 857005-81-3 (2-Amino-6-chloro-3-methylbenzoic Acid)

2-Amino-6-chloro-3-methylbenzoic Acid is a substituted benzoic acid derivative with a molecular formula of C8H8ClNO2. This compound features both amino and chloro functional groups at the 2- and 6-positions, respectively, along with a methyl group at the 3-position, making it a versatile intermediate in organic synthesis. Its structural properties enable applications in pharmaceutical and agrochemical research, particularly in the development of active ingredients and fine chemicals. The compound's high purity and stability under standard conditions ensure reliable performance in synthetic processes. Its distinct substitution pattern also facilitates selective reactions, offering utility in the preparation of complex heterocyclic systems and specialized derivatives.
2-Amino-6-chloro-3-methylbenzoic Acid structure
857005-81-3 structure
Product Name:2-Amino-6-chloro-3-methylbenzoic Acid
CAS No:857005-81-3
MF:C8H8ClNO2
MW:185.607621192932
MDL:MFCD06409109
CID:1056740
PubChem ID:28881281
Update Time:2025-06-09

2-Amino-6-chloro-3-methylbenzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-Amino-6-chloro-3-methylbenzoic Acid
    • 2-Amino-6-chlor-3-methoxy-benzoesaeure
    • 2-Amino-6-chlor-3-methyl-benzoesaeure
    • 2-amino-6-chloro-3-methoxy-benzoic acid
    • 2-amino-6-chloro-3-methyl-benzoic acid
    • Benzoic acid,2-amino-6-chloro-3-methoxy
    • AKOS005133216
    • MFCD06409109
    • SY015358
    • 857005-81-3
    • A914640
    • Z228589694
    • CS-0132929
    • SCHEMBL950473
    • EN300-65917
    • 2-amino-6-chloro-3-methylbenzoic acid, AldrichCPR
    • 2-amino-6-chloro-3-methylbenzoicacid
    • AC7668
    • DB-346856
    • MDL： MFCD06409109
    • Inchi： 1S/C8H8ClNO2/c1-4-2-3-5(9)6(7(4)10)8(11)12/h2-3H,10H2,1H3,(H,11,12)
    • InChI Key： QIZZHPAEYROYKH-UHFFFAOYSA-N
    • SMILES： ClC1C=CC(C)=C(C=1C(=O)O)N

Computed Properties

  • Exact Mass: 185.02400
  • Monoisotopic Mass: 185.024
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 186
  • 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
  • Topological Polar Surface Area: 63.3A^2
  • XLogP3: 2.3

Experimental Properties

  • PSA: 63.32000
  • LogP: 2.51000

2-Amino-6-chloro-3-methylbenzoic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Matrix Scientific
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Matrix Scientific
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 $ 185.00 2022-06-08
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Apollo Scientific
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eNovation Chemicals LLC
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Chemenu
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Chemenu
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Alichem
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