Cas no 71648-41-4 (3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester)

3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester structure
71648-41-4 structure
Product Name:3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester
CAS No:71648-41-4
MF:C10H17NO4
MW:215.24628329277
CID:862665
PubChem ID:144501
Update Time:2025-09-27

3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester Chemical and Physical Properties

Names and Identifiers

    • cyclohexanepropionic acid, 1-nitro methyl ester
    • methyl 3-(1-nitrocyclohexyl)propanoate
    • cyclohexanepropanoic acid, 1-nitro-, methyl ester
    • Cyclohexanepropionic acid, 1-nitro-, methyl ester
    • 71648-41-4
    • AKOS024323045
    • NSC 65616
    • 3-(1-Nitro-Cyclohexyl)-Propionic Acid Methyl Ester
    • NSC-65616
    • Methyl (1-nitrocyclohexane)propionate
    • AVXYQXCOTAFKQF-UHFFFAOYSA-N
    • METHYL 1-NITROCYCLOHEXANEPROPIONATE
    • DTXSID00221894
    • NCIOpen2_003021
    • NSC65616
    • 3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester
    • Inchi: 1S/C10H17NO4/c1-15-9(12)5-8-10(11(13)14)6-3-2-4-7-10/h2-8H2,1H3
    • InChI Key: AVXYQXCOTAFKQF-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1(CCC(=O)OC)CCCCC1)=O

Computed Properties

  • Exact Mass: 215.11581
  • Monoisotopic Mass: 215.11575802g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 240
  • 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: 1.8
  • Topological Polar Surface Area: 72.1?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 299.3±9.0 °C at 760 mmHg
  • Flash Point: 120.6±20.7 °C
  • PSA: 69.44
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

3-(1-Nitro-cyclohexyl)propionic Acid Methyl Ester Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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