Phenylmalonic acid


Catalog No:   FT-0657774

CAS No:   2613-89-0

  • Molecular Formula:  180.16
  • Formula Weight: C9H8O4
  • Inchl Key: WWYDYZMNFQIYPT-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H8O4/c10-8(11)7(9(12)13)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)(H,12,13)

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Symbol: GHS07
CAS: 2613-89-0
Flash_Point: 187.5±21.1 °C
Product_Name: Phenylmalonic acid
Bolling_Point: 363.0±30.0 °C at 760 mmHg
FW: 180.157
Melting_Point: 149-152 °C (dec.)(lit.)
MF: C9H8O4
Density: 1.4±0.1 g/cm3
Refractive_Index: 1.592
Vapor_Pressure: 0.0±0.9 mmHg at 25°C
Flash_Point: 187.5±21.1 °C
LogP: 1.45
Bolling_Point: 363.0±30.0 °C at 760 mmHg
Water_Solubility: soluble
PSA: 74.60000
Molecular_Structure: ['1 . Molar refractive index 4356 ', '2 . Molar volume (m3/mol)1287 ', '3 . Parachor (902K)3659 ', '4 . Surface tension 652 ', '5 . Polarizability 1727']
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 746 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :192 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point: 149-152 °C (dec.)(lit.)
MF: C9H8O4
Exact_Mass: 180.042252
FW: 180.157
Density: 1.4±0.1 g/cm3
More_Info: ['1 . Appearance White to 类White 结晶粉末 ', '2 . Density(g/mL,25/4℃)无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)153-155 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index无可用 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V) 无可用 ', '19 . Solubility Soluble in Water Ethanol Ethyl ether ,微Soluble in 氯仿二硫化碳苯']
Symbol: GHS07
Risk_Statements(EU): R22;R41
HS_Code: 2917399090
WGK_Germany: 3
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Gloves
RIDADR: NONH for all modes of transport
Hazard_Codes: Xn:Harmful;
Warning_Statement: P261-P305 + P351 + P338
Safety_Statements: H315-H319-H335

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