Cas no 68526-84-1 (Alcohols, C8-10-iso-,C9-rich)

Alcohols, C8-10-iso-,C9-rich structure
Alcohols, C8-10-iso-,C9-rich structure
Product Name:Alcohols, C8-10-iso-,C9-rich
CAS No:68526-84-1
MF:C9H20O
MW:144.254503250122
CID:520035
PubChem ID:17072
Update Time:2025-04-19

Alcohols, C8-10-iso-,C9-rich Chemical and Physical Properties

Names and Identifiers

    • Alcohols, C8-10-iso-,C9-rich
    • Alcohols, C8-1O-iso-, C9-rich
    • FT-0614411
    • NEOFLEX 9
    • CHEBI:188348
    • EINECS 271-233-5
    • NS00002259
    • iso-nonanol
    • Isononyl alcohol
    • 7-Methyloctanol
    • Isononanol
    • EXXAL 9
    • A1-21212
    • EC 248-471-3
    • 1-Octanol, 7-methyl-
    • 7-methyl-octan-1-ol
    • UNII-KY36Z95MC2
    • D98911
    • iso-nonylalcohol
    • 7-METHYL-1-OCTANOL
    • EC 271-233-5
    • W-109201
    • 2430-22-0
    • EXXAL 9S
    • EINECS 248-471-3
    • KY36Z95MC2
    • DTXSID2058675
    • 68526-84-1
    • AKOS006272384
    • EXXSOL 9
    • (R)-isononyl alcohol
    • 4-01-00-01806 (Beilstein Handbook Reference)
    • 7-methyloctan-1-ol
    • SCHEMBL61074
    • OXOCOL 900
    • J-015436
    • Q22668724
    • 27458-94-2
    • BRN 1733654
    • FT-0672043
    • 7-Methyl-octanol
    • Q27282495
    • Inchi: 1S/C9H20O/c1-9(2)7-5-3-4-6-8-10/h9-10H,3-8H2,1-2H3
    • InChI Key: QDTDKYHPHANITQ-UHFFFAOYSA-N
    • SMILES: OCCCCCCC(C)C

Computed Properties

  • Exact Mass: 144.15100
  • Monoisotopic Mass: 144.151415
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 6
  • Complexity: 59.7
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.5
  • Topological Polar Surface Area: 20.2

Experimental Properties

  • Density: 0.809?g/mL?at 25?°C(lit.)
  • Melting Point: 64.5 °C
  • Boiling Point: 178?°C(lit.)
  • Flash Point: 158?°F
  • Refractive Index: n20/D 1.423(lit.)
  • PSA: 20.23000
  • LogP: 2.43950

Alcohols, C8-10-iso-,C9-rich Security Information

  • Hazardous Material transportation number:UN 3082
  • WGK Germany:2
  • Safety Instruction: 24/25
  • RTECS:MJ3325000
  • Packing Group:III
  • Packing Group:III
  • HazardClass:9
  • PackingGroup:III
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