Product Name

  • Name

    5-ethylnon-3-en-2-one

  • EINECS
  • CAS No. 10137-90-3
  • Density 0.836g/cm3
  • Solubility
  • Melting Point
  • Formula C11H20 O
  • Boiling Point 236.5°C at 760 mmHg
  • Molecular Weight 168.279
  • Flash Point 104.1°C
  • Transport Information
  • Appearance
  • Safety Mildly toxic by ingestion and skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
  • Risk Codes
  • Molecular Structure Molecular Structure of 10137-90-3 (5-ethylnon-3-en-2-one)
  • Hazard Symbols
  • Synonyms 5-Ethyl-3-nonen-2-one
  • PSA 17.07000
  • LogP 3.34800

5-Ethyl-3-nonen-2-one Chemical Properties

Molecule structure of 5-Ethyl-3-nonen-2-one (CAS NO.10137-90-3) :

IUPAC Name: (E)-5-ethylnon-3-en-2-one 
Molecular Weight: 168.2759 g/mol
Molecular Formula: C11H20O
Density: 0.836 g/cm3
Boiling Point: 236.5 °C at 760 mmHg
Flash Point: 104.1 °C 
EINECS: 233-379-8  
Molar Volume: 201.2 cm3
Polarizability: 21.03*10-24 cm3
Surface Tension: 27.1 dyne/cm 
Enthalpy of Vaporization: 47.33 kJ/mol
Vapour Pressure: 0.0473 mmHg at 25 °C
XLogP3-AA: 3.7
H-Bond Acceptor: 1
Rotatable Bond Count: 6
Tautomer Count: 5
Exact Mass: 168.151415
MonoIsotopic Mass: 168.151415
Topological Polar Surface Area: 17.1
Heavy Atom Count: 12
Complexity: 147
Undefined Atom StereoCenter Count: 1
Defined Bond StereoCenter Count: 1
Covalently-Bonded Unit Count: 1
Canonical SMILES: CCCCC(CC)C=CC(=O)C
Isomeric SMILES: CCCCC(CC)/C=C/C(=O)C
InChI: InChI=1S/C11H20O/c1-4-6-7-11(5-2)9-8-10(3)12/h8-9,11H,4-7H2,1-3H3/b9-8+
InChIKey of 5-Ethyl-3-nonen-2-one (CAS NO.10137-90-3) : SWBGUNASIKSCCO-CMDGGOBGSA-N

5-Ethyl-3-nonen-2-one Toxicity Data With Reference

1.    

skn-rbt 10 mg/24H open MLD

    AMIHBC    AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61.
2.    

eye-rbt 500 mg open

    AMIHBC    AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61.
3.    

orl-rat LD50:8120 mg/kg

    AMIHBC    AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61.
4.    

skn-rbt LD50:8480 mg/kg

    AMIHBC    AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61.

5-Ethyl-3-nonen-2-one Safety Profile

Mildly toxic by ingestion and skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

5-Ethyl-3-nonen-2-one Specification

 5-Ethyl-3-nonen-2-one (CAS NO.10137-90-3) is also called 5-ethylnon-3-en-2-one .

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