Cas no 1470-50-4 (oct-2-enoic acid)

oct-2-enoic acid structure
oct-2-enoic acid structure
Product Name:oct-2-enoic acid
CAS No:1470-50-4
MF:C8H14O2
MW:142.195562839508
MDL:MFCD00002706
CID:163410
PubChem ID:73850
Update Time:2025-04-19

oct-2-enoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Octenoic acid
    • Oct-2-enoic acid
    • NSC 66570
    • T2 OCTENOIC ACID
    • FEMA NUMBER 3957
    • RARECHEM AL BK 0164
    • (2E)-2-Octenoic acid
    • TRANS-2-OCTENOIC ACID
    • 2-OCTENOIC ACID (TRANS-)
    • 2-Octenoic acid oct-2-enoic acid
    • 2-OCTENOIC ACID 97%
    • NCIOpen2_000192
    • SY049616
    • 2-Octenic acid
    • MFCD00002706
    • D91783
    • FT-0604932
    • 2-Octenoic acid, (Z)-
    • DTXSID50862675
    • oct-2-enoic acid
    • MDL: MFCD00002706
    • Inchi: 1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
    • InChI Key: CWMPPVPFLSZGCY-UHFFFAOYSA-N
    • SMILES: OC(C=CCCCCC)=O

Computed Properties

  • Exact Mass: 274.17808
  • Monoisotopic Mass: 142.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 116
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 2.7
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 0.944?g/mL?at 25?°C(lit.)
  • Melting Point: 5-6?°C(lit.)
  • Boiling Point: 154?°C22?mm Hg(lit.)
  • Flash Point: >230?°F
  • Refractive Index: n20/D 1.4588(lit.)
  • PSA: 94.83

oct-2-enoic acid Security Information

  • Hazardous Material transportation number:UN 3265 8/PG 2
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: 26-27-28-36/37/39-45
  • Hazardous Material Identification: C
  • Risk Phrases:34

oct-2-enoic acid Pricemore >>

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