Cas no 219312-01-3 (2-(3-aminophenoxy)acetonitrile)

2-(3-aminophenoxy)acetonitrile structure
219312-01-3 structure
Product Name:2-(3-aminophenoxy)acetonitrile
CAS No:219312-01-3
MF:C8H8N2O
MW:148.16192150116
CID:243587
PubChem ID:18789699
Update Time:2025-04-19

2-(3-aminophenoxy)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • Acetonitrile,2-(3-aminophenoxy)-
    • 2-(3-aminophenoxy)Acetonitrile
    • (3-Aminophenoxy)acetonitrile
    • Acetonitrile,(3-aminophenoxy)- (9CI)
    • BIHMHFUQWCIATN-UHFFFAOYSA-N
    • Z285182504
    • 219312-01-3
    • EN300-39906
    • (3-amino-phenoxy)-acetonitrile
    • (3-Aminophenoxy)-acetonitrile
    • F2158-1547
    • ACETONITRILE,(3-AMINOPHENOXY)-
    • DTXSID60596292
    • SCHEMBL3054840
    • AKOS000157017
    • Acetonitrile, (3-aminophenoxy)- (9CI)
    • FT-0718153
    • DA-28498
    • G34037
    • 2-(3-aminophenoxy)acetonitrile
    • Inchi： 1S/C8H8N2O/c9-4-5-11-8-3-1-2-7(10)6-8/h1-3,6H,5,10H2
    • InChI Key： BIHMHFUQWCIATN-UHFFFAOYSA-N
    • SMILES： O(CC#N)C1C=CC=C(C=1)N

Computed Properties

  • Exact Mass: 148.06374
  • Monoisotopic Mass: 148.063662883g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 161
  • 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: 0.7
  • Topological Polar Surface Area: 59?2

Experimental Properties

  • PSA: 59.04

2-(3-aminophenoxy)acetonitrile Pricemore >>

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