Cas no 597-76-2 (3-Ethyl-3-hexanol)

3-Ethyl-3-hexanol structure
3-Ethyl-3-hexanol structure
Product Name:3-Ethyl-3-hexanol
CAS No:597-76-2
MF:C8H18O
MW:130.227922916412
MDL:MFCD00039616
CID:82650
PubChem ID:69008
Update Time:2025-04-18

3-Ethyl-3-hexanol Chemical and Physical Properties

Names and Identifiers

    • 3-Ethyl-3-hexanol
    • 3-ethylhexan-3-ol
    • UNII-TP5DX5CP9C
    • TP5DX5CP9C
    • FT-0632485
    • 597-76-2
    • EINECS 209-908-3
    • NSC28044
    • 1,1-Diethyl-1-butanol
    • NS00034237
    • 3-ethyl-hexan-3-ol
    • 1,1-Diethylbutanol
    • DTXSID60208409
    • NSC 28044
    • AKOS009158809
    • SCHEMBL191751
    • MFCD00039616
    • WNDLTOTUHMHNOC-UHFFFAOYSA-N
    • NSC-28044
    • 3-Hexanol, 3-ethyl-
    • G77543
    • DB-053459
    • MDL: MFCD00039616
    • Inchi: 1S/C8H18O/c1-4-7-8(9,5-2)6-3/h9H,4-7H2,1-3H3
    • InChI Key: WNDLTOTUHMHNOC-UHFFFAOYSA-N
    • SMILES: OC(CC)(CC)CCC

Computed Properties

  • Exact Mass: 130.13600
  • Monoisotopic Mass: 130.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 65
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.5
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Color/Form: Not available
  • Density: 0.83
  • Melting Point: -61.15°C (estimate)
  • Boiling Point: 160.1°C
  • Refractive Index: 1.4250
  • PSA: 20.23000
  • LogP: 2.33760
  • Solubility: Not available

3-Ethyl-3-hexanol Security Information

3-Ethyl-3-hexanol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
E918730-100mg
3-Ethyl-3-hexanol
597-76-2
100mg
$64.00 2023-05-18
TRC
E918730-500mg
3-Ethyl-3-hexanol
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500mg
$87.00 2023-05-18
TRC
E918730-1g
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$ 95.00 2022-06-05
abcr
AB126333-1 g
3-Ethyl-3-hexanol; 98%
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€52.40 2022-03-25
abcr
AB126333-5 g
3-Ethyl-3-hexanol; 98%
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€114.80 2022-03-25
TRC
E918730-1000mg
3-Ethyl-3-hexanol
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1g
$115.00 2023-05-18
A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI
B20859-1g
3-Ethyl-3-hexanol, 98%
597-76-2 98%
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¥582.00 2023-02-09
A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI
B20859-5g
3-Ethyl-3-hexanol, 98%
597-76-2 98%
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¥2394.00 2023-02-09
A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI
B20859-25g
3-Ethyl-3-hexanol, 98%
597-76-2 98%
25g
¥8719.00 2023-02-09
abcr
AB126333-5g
3-Ethyl-3-hexanol, 98%; .
597-76-2 98%
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€131.80 2024-04-17

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