Cas no 60713-54-4 (1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester)

1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester structure
60713-54-4 structure
Product Name:1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester
CAS No:60713-54-4
MF:C12H9ClO4S
MW:284.715461492538
CID:1621827
PubChem ID:21321991
Update Time:2025-04-21

1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester
    • 60713-54-4
    • methyl 2-chlorosulfonylnaphthalene-1-carboxylate
    • SCHEMBL11505932
    • methyl2-(chlorosulfonyl)naphthalene-1-carboxylate
    • EN300-7440578
    • methyl 2-(chlorosulfonyl)naphthalene-1-carboxylate
    • Inchi: 1S/C12H9ClO4S/c1-17-12(14)11-9-5-3-2-4-8(9)6-7-10(11)18(13,15)16/h2-7H,1H3
    • InChI Key: UVDCQQQGPORSQT-UHFFFAOYSA-N
    • SMILES: ClS(C1=CC=C2C=CC=CC2=C1C(=O)OC)(=O)=O

Computed Properties

  • Exact Mass: 283.99107
  • Monoisotopic Mass: 283.9910076g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 414
  • 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: 3
  • Topological Polar Surface Area: 68.8?2

Experimental Properties

  • PSA: 60.44

1-Naphthalenecarboxylic acid, 2-(chlorosulfonyl)-, methyl ester Pricemore >>

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