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Moniliformin

  • Name Moniliformin
  • EINECSN/A
  • CAS No. 31876-38-7
  • Densityg/cm3
  • PSA54.37000
  • LogP-0.41990
  • SolubilityN/A
  • Melting Point163°C (rough estimate)
  • FormulaC4H2 O3
  • Boiling Point239.6°Cat760mmHg
  • Molecular Weight98.0581
  • Flash Point113°C
  • Transport InformationN/A
  • AppearanceN/A
  • SafetyPoison by ingestion and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes.
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 31876-38-7 (moniliformin)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data11

Moniliformin Chemical Properties

Molecule structure of Moniliformin (CAS NO.31876-38-7) :

IUPAC Name: 3-hydroxycyclobut-3-ene-1,2-dione 
Molecular Weight: 98.05688 g/mol
Molecular Formula: C4H2O3 
Density: 1.876 g/cm3 
Boiling Point: 239.6 °C at 760 mmHg
Flash Point: 113 °C
Index of Refraction: 1.686
Molar Refractivity: 19.89 cm3
Molar Volume: 52.2 cm3
Polarizability: 7.88*10-24 cm3
Surface Tension: 116.8 dyne/cm 
Enthalpy of Vaporization: 55.38 kJ/mol 
Vapour Pressure: 0.00695 mmHg at 25 °C
XLogP3-AA: -0.6
H-Bond Donor: 1
H-Bond Acceptor: 3
Tautomer Count: 2
Exact Mass: 98.000394
MonoIsotopic Mass: 98.000394
Topological Polar Surface Area: 54.4
Heavy Atom Count: 7
Complexity: 166
Canonical SMILES: C1=C(C(=O)C1=O)O
InChI: InChI=1S/C4H2O3/c5-2-1-3(6)4(2)7/h1,5H
InChIKey: KGPQKNJSZNXOPV-UHFFFAOYSA-N

Moniliformin Toxicity Data With Reference

1.    

orl-rat LD50:41 mg/kg

    FCTXAV    Food and Cosmetics Toxicology. 15 (1977),579.
2.    

ipr-mus LD50:21 mg/kg

    POSCAL    Poultry Science. 60 (1981),1415.
3.    

orl-ckn LD50:4 mg/kg

    FCTXAV    Food and Cosmetics Toxicology. 15 (1977),579.
4.    

orl-dck LD50:3680 mg/kg

    FCTXAV    Food and Cosmetics Toxicology. 15 (1977),579.

Moniliformin Consensus Reports

EPA Genetic Toxicology Program.

Moniliformin Safety Profile

Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes.

Moniliformin Specification

 Moniliformin (CAS NO.31876-38-7) is also called 1-Hydroxy-cyclobut-1-ene-3,4-dione ; 3-Cyclobutene-1,2-dione, 3-hydroxy- ; 3-Hydroxy-3-cyclobutene-1,2-dione ; 3-Hydroxy-3-cyclobutenedione ; BRN 1925339 ; CCRIS 4943 ; Cyclobutenedione, hydroxy- ; Hydroxycyclobutenedione ; NSC 292896 ; Semisquaric acid ; 1-Hydroxycyclobut-1-ene-3,4-dione . Moniliformin (CAS NO.31876-38-7) is high toxic. It is flammable. It will emit stimulate pungent smoke by fire. So the storage environment should be ventilate, low-temperature and dry. Keep Moniliformin (CAS NO.31876-38-7) separate from raw materials of food.

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