Cas no 54773-11-4 (Ethyl 1-benzylazetidine-2-carboxylate)

Ethyl 1-benzylazetidine-2-carboxylate structure
54773-11-4 structure
Product Name:Ethyl 1-benzylazetidine-2-carboxylate
CAS No:54773-11-4
MF:C13H17NO2
MW:219.279583692551
MDL:MFCD17215354
CID:1038118
PubChem ID:11074886
Update Time:2025-04-20

Ethyl 1-benzylazetidine-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 1-benzylazetidine-2-carboxylate
    • (+/-)-ethyl 1-benzylazetidine-2-carboxylate
    • 1-benzylazetidine-2-carboxylic acid ethyl ester
    • 1-benzyl-azetidine-2-carboxylic acid ethyl ester
    • AK-59498
    • ANW-74363
    • CTK8C5154
    • ethyl (+/-)-1-benzylazetidine-2-carboxylate
    • HT141
    • N-benzyl-2-ethoxycarbonylazetidine
    • N-benzylazetidine-2-carboxylic acid ethyl ester
    • RP07672
    • SureCN2769755
    • DB-370121
    • 1-(PHENYLMETHYL)-2-AZETIDINECARBOXYLIC ACID ETHYL ESTER
    • DTXSID80454305
    • (+/-)Ethyl 1-benzylazetidine-2-carboxylate
    • SCHEMBL2769755
    • SB50751
    • 54773-11-4
    • ethyl n-benzylazetidine-2-carboxylate
    • AM20040691
    • Ethyl1-benzylazetidine-2-carboxylate
    • MDWJXMWPDZPGEC-UHFFFAOYSA-N
    • AKOS015890721
    • CS-0089650
    • J-520525
    • MDL: MFCD17215354
    • Inchi: 1S/C13H17NO2/c1-2-16-13(15)12-8-9-14(12)10-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3
    • InChI Key: MDWJXMWPDZPGEC-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1CCN1CC1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 219.12601
  • Monoisotopic Mass: 219.125928785g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 236
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 29.5?2

Experimental Properties

  • Density: 1.127
  • Boiling Point: 290.141 °C at 760 mmHg
  • Flash Point: 290.141 °C at 760 mmHg
  • Refractive Index: 1.552
  • PSA: 29.54

Ethyl 1-benzylazetidine-2-carboxylate Pricemore >>

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