2-Methyloctanoic acid (CAS: 3004-93-1) - Chemical Structure and Molecular Formula
2-Methyloctanoic acid (CAS: 3004-93-1) - Chemical Structure Thumbnail

2-Methyloctanoic acid

Catalog No:   FT-0691811

CAS No:   3004-93-1

  • Chemical Name:  2-Methyloctanoic acid
  • Molecular Formula:  C9H18O2
  • Molecular Weight:  158.24
  • InChI Key:  YSEQNZOXHCKLOG-UHFFFAOYSA-N
  • InChI:  InChI=1S/C9H18O2/c1-3-4-5-6-7-8(2)9(10)11/h8H,3-7H2,1-2H3,(H,10,11)
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-METHYLOCTANOIC ACID
Bolling_Point: 253.4ºC at 760mmHg
Density: 0.919g/cm3
MF: C9H18O2
CAS: 3004-93-1
Melting_Point: N/A
Flash_Point: 129.7ºC
FW: 158.23800
MF: C9H18O2
Bolling_Point: 253.4ºC at 760mmHg
Exact_Mass: 158.13100
More_Info: ['1 . Boiling point（ºC）88（5332） ', '2 相对. Density(d204) 14281']
PSA: 37.30000
Flash_Point: 129.7ºC
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :110 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Density: 0.919g/cm3
Molecular_Structure: ['1 . Molar refractive index 4526 ', '2 . Molar volume 1720 ', '3 . Parachor （902K）4093 ', '4 . Surface tension 320 ', '5 . Polarizability 1794']
FW: 158.23800
LogP: 2.67750
Refractive_Index: 1.439
Risk_Statements(EU): 36/37/38
HS_Code: 2915900090
Safety_Statements: 26-36/37/39

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