TRANS-2-HEXENOIC ACID (CAS: 1191-04-4) - Chemical Structure and Molecular Formula
TRANS-2-HEXENOIC ACID (CAS: 1191-04-4) - Chemical Structure Thumbnail

TRANS-2-HEXENOIC ACID

Catalog No:   FT-0612495

CAS No:   1191-04-4

  • Chemical Name:  TRANS-2-HEXENOIC ACID
  • Molecular Formula:  C6H10O2
  • Molecular Weight:  114.14
  • InChI Key:  NIONDZDPPYHYKY-SNAWJCMRSA-N
  • InChI:  InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
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: (2E)-2-Hexenoic acid
Flash_Point: 115.4±9.6 °C
Melting_Point: 33-35ºC(lit.)
FW: 114.142
Density: 1.0±0.1 g/cm3
CAS: 1191-04-4
Bolling_Point: 216.5±0.0 °C at 760 mmHg
MF: C6H10O2
Molecular_Structure: ['1 . Molar refractive index 3146 ', '2 . Molar volume 1158 ', '3 . Parachor （902K）2798 ', '4 . Surface tension 340 ', '5 . Polarizability 1247']
Flash_Point: 115.4±9.6 °C
Refractive_Index: 1.456
FW: 114.142
Density: 1.0±0.1 g/cm3
Bolling_Point: 216.5±0.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :16 ', '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 :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :947 ', '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 :1 ', '15. Covalently-Bonded Unit Count :1']
LogP: 1.87
Melting_Point: 33-35ºC(lit.)
PSA: 37.30000
MF: C6H10O2
More_Info: ['1. Density（g/cm3）0965 ', '2. Melting point（ºC）33-35 ', '3. Boiling point（760 mmHg,ºC）217 ', '4. Flash point（ºC）1154 ', '5. Refractive index（n20）1446']
Vapor_Pressure: 0.1±0.8 mmHg at 25°C
Exact_Mass: 114.068077
Hazard_Codes: C: Corrosive;
RIDADR: UN 2829 8/PG 3
Risk_Statements(EU): 34
Safety_Statements: 26-36/37/39-45

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