Cas no 1504-63-8 (4-Nitrocinnamyl Alcohol)

4-Nitrocinnamyl Alcohol structure
4-Nitrocinnamyl Alcohol structure
Product Name:4-Nitrocinnamyl Alcohol
CAS No:1504-63-8
MF:C9H9NO3
MW:179.172662496567
MDL:MFCD00017045
CID:83731
PubChem ID:87573999
Update Time:2025-04-18

4-Nitrocinnamyl Alcohol Chemical and Physical Properties

Names and Identifiers

    • 4-Nitrocinnamyl alcohol
    • 4-Nitrocinnamyl Alco
    • 4-Nitrociamyl alcohol
    • 4-Nitrozimtalkohol
    • P-NITROCINNAMYL ALCOHOL
    • 3-(4-Nitrophenyl)-2-propenol
    • 3-(4-nitrophenyl)-2-propen-1-o
    • 3-(P-NITROPHENYL)-2-PROPEN-1-OL
    • 3-(4-NITROPHENYL)-2-PROPEN-1-OL
    • 3-(4-Nitrophenyl)prop-2-en-1-ol
    • 2-Propen-1-ol, 3-(4-nitrophenyl)-
    • 2-Propen-1-ol, 3-(p-nitrophenyl)-
    • (E)-3-(4-nitrophenyl)prop-2-en-1-ol
    • 4-NitrocinnamylAlcohol
    • LGXXEDSIJZHDBN-UHFFFAOYSA-N
    • 3-(4-nitrophenyl)-prop-2-en-1-ol
    • 2-Propen-1-ol,3-(4-nitrophenyl)-
    • 4-Nitrocinnamyl alcohol, 98%
    • AKOS015833453
    • A884157
    • RS-1031
    • MFCD00017045
    • 1504-63-8
    • (E)-3-(4-Nitrophenyl)-2-propenol
    • CS-0202290
    • LGXXEDSIJZHDBN-OWOJBTEDSA-N
    • AKOS015916548
    • ?4-NITROCINNAMYL ALCOHOL
    • (2E)-3-(4-nitrophenyl)prop-2-en-1-ol
    • T71811
    • 2-Propen-1-ol, 3-(4-nitrophenyl)-, (2E)-
    • ALBB-023608
    • 4-Nitrocinnamyl Alcohol
    • MDL: MFCD00017045
    • Inchi: 1S/C9H9NO3/c11-7-1-2-8-3-5-9(6-4-8)10(12)13/h1-6,11H,7H2/b2-1+
    • InChI Key: LGXXEDSIJZHDBN-OWOJBTEDSA-N
    • SMILES: OC/C=C/C1C=CC(=CC=1)[N+](=O)[O-]
    • BRN: 1948238

Computed Properties

  • Exact Mass: 179.05800
  • Monoisotopic Mass: 179.058
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 190
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 66

Experimental Properties

  • Color/Form: Powder.
  • Density: 1.2822 (rough estimate)
  • Melting Point: 126.0 to 130.0 deg-C
  • Boiling Point: 311.69°C (rough estimate)
  • Flash Point: 144.1°C
  • Refractive Index: 1.5600 (estimate)
  • Solubility: Soluble in chloroform, dichloromethane and ethyl Acetate.
  • PSA: 66.05000
  • LogP: 2.12350
  • Solubility: Not determined

4-Nitrocinnamyl Alcohol Security Information

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