Cas no 150864-94-1 (1-ethylcyclobutane-1-carboxylic acid)

1-ethylcyclobutane-1-carboxylic acid structure
150864-94-1 structure
Product Name:1-ethylcyclobutane-1-carboxylic acid
CAS No:150864-94-1
MF:C7H12O2
MW:128.168982505798
MDL:MFCD18253511
CID:2778762
PubChem ID:21996033
Update Time:2025-04-21

1-ethylcyclobutane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-ethylcyclobutane-1-carboxylic acid
    • CCG-358805
    • SCHEMBL1055977
    • EN300-102357
    • XLUXAKJPHJEFKL-UHFFFAOYSA-N
    • DA-09996
    • MFCD18253511
    • CS-0037445
    • 1-Ethylcyclobutanecarboxylic acid
    • DTXSID40621334
    • 150864-94-1
    • 1-Ethylcyclobutanecarboxylicacid
    • KS-8923
    • 1-ethyl-Cyclobutanecarboxylic acid
    • SY102575
    • Cyclobutanecarboxylic acid, 1-ethyl-
    • F8881-3740
    • AKOS006381265
    • AB92245
    • Ethylcyclobutane carboxylate
    • Z1205494281
    • DTXCID30572088
    • 830-293-8
    • AGA86494
    • MDL: MFCD18253511
    • Inchi: 1S/C7H12O2/c1-2-7(6(8)9)4-3-5-7/h2-5H2,1H3,(H,8,9)
    • InChI Key: XLUXAKJPHJEFKL-UHFFFAOYSA-N
    • SMILES: OC(C1(CC)CCC1)=O

Computed Properties

  • Exact Mass: 128.083729621g/mol
  • Monoisotopic Mass: 128.083729621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 125
  • 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: 1.5
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 219.6±8.0 °C at 760 mmHg
  • Flash Point: 101.4±13.1 °C
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

1-ethylcyclobutane-1-carboxylic acid Security Information

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