2-Bromo-3-methylvalericacid (CAS: 42880-22-8) - Chemical Structure and Molecular Formula
2-Bromo-3-methylvalericacid (CAS: 42880-22-8) - Chemical Structure Thumbnail

2-Bromo-3-methylvalericacid

Catalog No:   FT-0659340

CAS No:   42880-22-8

  • Chemical Name:  2-Bromo-3-methylvalericacid
  • Molecular Formula:  C6H11BrO2
  • Molecular Weight:  195.05
  • InChI Key:  GQZXYZIKUQUVKE-UHFFFAOYSA-N
  • InChI:  InChI=1S/C6H11BrO2/c1-3-4(2)5(7)6(8)9/h4-5H,3H2,1-2H3,(H,8,9)
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
Product_Name: 2-bromo-3-methylpentanoic acid
Bolling_Point: 240.5ºC at 760mmHg
Density: 1.432g/cm3
MF: C6H11BrO2
CAS: 42880-22-8
Melting_Point: N/A
Flash_Point: 99.3ºC
FW: 195.05400
MF: C6H11BrO2
Bolling_Point: 240.5ºC at 760mmHg
Exact_Mass: 193.99400
More_Info: ['1. Appearance Colourless 油状Liquid 。 ', '2. Boiling point125-140℃/239-267kPa。']
PSA: 37.30000
Flash_Point: 99.3ºC
Computational_Chemistry: ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :103 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :2 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Density: 1.432g/cm3
Molecular_Structure: ['1 . Molar refractive index 3905 ', '2 . Molar volume 1361 ', '3 . Parachor （902K）3395 ', '4 . Surface tension 387 ', '5 . Polarizability 1548']
FW: 195.05400
LogP: 1.88060
Refractive_Index: 1.485
HS_Code: 2915900090

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