Product Name

  • Name

    Pentylphosphonic acid p-nitrophenylethyl ester

  • EINECS
  • CAS No. 3015-75-6
  • Density 1.182g/cm3
  • Solubility
  • Melting Point
  • Formula C13H20 N O5 P
  • Boiling Point 408.1°Cat760mmHg
  • Molecular Weight 301.279
  • Flash Point 200.6°C
  • Transport Information
  • Appearance
  • Safety Poison by intravenous route. When heated to decomposition it emits very toxic fumes of POx and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 3015-75-6 (Pentylphosphonic acid p-nitrophenylethyl ester)
  • Hazard Symbols
  • Synonyms Phosphonicacid, pentyl-, ethyl p-nitrophenyl ester (6CI,7CI,8CI); p-Nitrophenyl ethylpentylphosphonate
  • PSA 91.16000
  • LogP 4.91660

Ethyl p-nitrophenyl pentylphosphonate Chemical Properties

IUPAC Name: 1-[ethoxy(pentyl)phosphoryl]oxy-4-nitrobenzene 
Empirical Formula: C13H20NO5P
Molecular Weight: 301.2754g/mol 
Index of Refraction: 1.507
Molar Refractivity: 75.89 cm3
Molar Volume: 254.8 cm3
Polarizability: 30.08×10-24cm3
Surface Tension: 42.3 dyne/cm
Density: 1.182 g/cm3
Flash Point: 200.6 °C
Enthalpy of Vaporization: 63.44 kJ/mol
Boiling Point: 408.1 °C at 760 mmHg
Vapour Pressure: 1.69E-06 mmHg at 25°C
Canonical SMILES: CCCCCP(=O)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-]
InChI: InChI=1S/C13H20NO5P/c1-3-5-6-11-20(17,18-4-2)19-13-9-7-12(8-10-13)14(15)16/h7-10H,3-6,11H2,1-2H3
InChIKey: WVEDKNWZBPHSRJ-UHFFFAOYSA-N
Structure of Ethyl p-nitrophenyl pentylphosphonate (CAS NO.3015-75-6):

Ethyl p-nitrophenyl pentylphosphonate Toxicity Data With Reference

1.    

ivn-rbt LD50:118 µg/kg

    BCPCA6    Biochemical Pharmacology. 13 (1964),1229.
2.    

ivn-gpg LD50:299 µg/kg

    BCPCA6    Biochemical Pharmacology. 13 (1964),1229.

Ethyl p-nitrophenyl pentylphosphonate Safety Profile

Poison by intravenous route. When heated to decomposition it emits very toxic fumes of POx and NOx.

Ethyl p-nitrophenyl pentylphosphonate Specification

 Ethyl p-nitrophenyl pentylphosphonate , its cas register number is 3015-75-6. It also can be called 4-06-00-01322 (Beilstein Handbook Reference) ; BRN 3413728 ; p-Nitrophenyl ethyl pentylphosphonate .When Ethyl p-nitrophenyl pentylphosphonate (CAS NO.3015-75-6) is heated to decomposition, it emits very toxic fumes of POx and NOx.

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