3-Hydroxy-2,2-dimethylpropanal (CAS: 597-31-9) - Chemical Structure and Molecular Formula
3-Hydroxy-2,2-dimethylpropanal (CAS: 597-31-9) - Chemical Structure Thumbnail

3-Hydroxy-2,2-dimethylpropanal

Catalog No:   FT-0648885

CAS No:   597-31-9

  • Chemical Name:  3-Hydroxy-2,2-dimethylpropanal
  • Molecular Formula:  C5H10O2
  • Molecular Weight:  102.13
  • InChI Key:  JJMOMMLADQPZNY-UHFFFAOYSA-N
  • InChI:  InChI=1S/C5H10O2/c1-5(2,3-6)4-7/h3,7H,4H2,1-2H3
Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Melting_Point: N/A
CAS: 597-31-9
MF: C5H10O2
Flash_Point: 60.3±15.2 °C
Product_Name: 3-Hydroxy-2,2-dimethylpropanal
Density: 1.0±0.1 g/cm3
FW: 102.132
Bolling_Point: 204.4±0.0 °C at 760 mmHg
Refractive_Index: 1.422
Vapor_Pressure: 0.1±0.8 mmHg at 25°C
Flash_Point: 60.3±15.2 °C
LogP: -0.42
Bolling_Point: 204.4±0.0 °C at 760 mmHg
FW: 102.132
PSA: 37.30000
Computational_Chemistry: ['1. XlogP :-01 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :665 ', '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']
MF: C5H10O2
Exact_Mass: 102.068077
Molecular_Structure: ['1 . Molar refractive index 2690 ', '2 . Molar volume 1059 ', '3 . Parachor （902K）2517 ', '4 . Surface tension 319 ', '5 . Polarizability 1066']
Density: 1.0±0.1 g/cm3
More_Info: ['1 . Boiling point（ºC）67~69(187kpa)， 172~173(996kpa,dec) ', '2 . Melting point（ºC）89~90 ', '3 . Flash point（ºC）83 ', '4 . Appearance 针状结晶体。']
HS_Code: 2912491000

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