Cas no 175140-65-5 (4-Pyridinamine, 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro-)

4-Pyridinamine, 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro- structure
175140-65-5 structure
Product Name:4-Pyridinamine, 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro-
CAS No:175140-65-5
MF:C11H16ClN3O2
MW:257.716641426086
CID:1368030
PubChem ID:11379881
Update Time:2025-04-20

4-Pyridinamine, 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyridinamine, 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro-
    • 2-chloro-N-(1-ethylpropyl)-6-methyl-3-nitro-4-Pyridinamine
    • KBWJFHDOMBAMNB-UHFFFAOYSA-N
    • DB-330216
    • SCHEMBL5843301
    • 175140-65-5
    • (2-chloro-6-methyl-3-nitro-pyridin-4-yl)-(1-ethyl-propyl)-amine
    • Inchi: 1S/C11H16ClN3O2/c1-4-8(5-2)14-9-6-7(3)13-11(12)10(9)15(16)17/h6,8H,4-5H2,1-3H3,(H,13,14)
    • InChI Key: KBWJFHDOMBAMNB-UHFFFAOYSA-N
    • SMILES: ClC1=C(C(=CC(C)=N1)NC(CC)CC)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 257.09328
  • Monoisotopic Mass: 257.0931045g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 256
  • 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: 4.4
  • Topological Polar Surface Area: 70.7?2

Experimental Properties

  • PSA: 68.06
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