Cas no 101251-12-1 (3-bromo-4-ethoxyBenzenamine)

3-bromo-4-ethoxyBenzenamine structure
3-bromo-4-ethoxyBenzenamine structure
Product Name:3-bromo-4-ethoxyBenzenamine
CAS No:101251-12-1
MF:C8H10BrNO
MW:216.07510137558
MDL:MFCD09955449
CID:2106046
PubChem ID:15270885
Update Time:2024-11-04

3-bromo-4-ethoxyBenzenamine Chemical and Physical Properties

Names and Identifiers

    • 3-bromo-4-ethoxyBenzenamine
    • 4-AMino-2-broMophenetole
    • 2-Brom-4-amino-phenetol
    • 2-Brom-4-amino-phenol-aethylaether
    • 3-bromo-4-ethoxyaniline
    • 4-Aethoxy-3-brom-anilin
    • Benzenamine, 3-bromo-4-ethoxy-
    • 101251-12-1
    • N12647
    • (3-Bromo-4-ethoxyphenyl)amine
    • BS-29921
    • MFCD09955449
    • AKOS010987615
    • BEA25112
    • CS-0112574
    • FT-0703157
    • GNTRARDJZSIQOK-UHFFFAOYSA-N
    • SCHEMBL2912192
    • DA-16383
    • MDL: MFCD09955449
    • Inchi: 1S/C8H10BrNO/c1-2-11-8-4-3-6(10)5-7(8)9/h3-5H,2,10H2,1H3
    • InChI Key: GNTRARDJZSIQOK-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C=CC=1OCC)N

Computed Properties

  • Exact Mass: 214.99500
  • Monoisotopic Mass: 214.99458g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 121
  • 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: 2.3
  • Topological Polar Surface Area: 35.2?2

Experimental Properties

  • PSA: 35.25000
  • LogP: 3.01120

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