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Basic Information
CAS No.: 1006-59-3
Name: 2,6-DIETHYLPHENOL
Article Data: 30
Molecular Structure:
Molecular Structure of 1006-59-3 (2,6-DIETHYLPHENOL)
Formula: C10H14O
Molecular Weight: 150.221
Synonyms: 2,6-DIETHYLPHENOL;2,6-DIETHYLPHENOL 95%;2,6-diethylphenol(SALTDATA: FREE)
EINECS: 213-744-8
Density: 0.979 g/cm3
Melting Point: 37.5°C
Boiling Point: 225.656 °C at 760 mmHg
Flash Point: 99.542 °C
Risk Codes: 36
Safety: 26
PSA: 20.23000
LogP: 2.51700
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  • 2,6-DIETHYL PHENOL

  • Casno:

    1006-59-3

    2,6-DIETHYL PHENOL

    Min.Order: 1 Gram

    FOB Price:  USD $ 0.0-0.0

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  • Phenol, 2,6-diethyl-

  • Casno:

    1006-59-3

    Phenol, 2,6-diethyl-

    Min.Order: 1 Gram

    FOB Price:  USD $ 1.0-2.0

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  • 2,6-DIETHYLPHENOL

  • Casno:

    1006-59-3

    2,6-DIETHYLPHENOL

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

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Chemistry

Molecular Structure of 2,6-Diethylphenol (1006-59-3):

EINECS: 213-744-8
IUPAC Name of 2,6-Diethylphenol (1006-59-3): 2,6-Diethylphenol 
Molecular Formula: C10H14O
Molecular Weight: 150.217560 g/mol
XLogP3: 3
H-Bond Donor: 1
H-Bond Acceptor: 1
Canonical SMILES: CCC1=C(C(=CC=C1)CC)O
InChI: InChI=1S/C10H14O/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7,11H,3-4H2,1-2H3
InChIKey: METWAQRCMRWDAW-UHFFFAOYSA-N
Index of Refraction: 1.527
Molar Refractivity: 47.23 cm3
Molar Volume: 153.4 cm3
Surface Tension: 35.8 dyne/cm
Density: 0.978 g/cm3
Flash Point: 99.5 °C
Enthalpy of Vaporization: 48.1 kJ/mol
Boiling Point: 225.7 °C at 760 mmHg
Vapour Pressure: 0.057 mmHg at 25 °C
Water Solubility: 743.9 mg/L at 25 °C
BRN: 2207162

Toxicity Data With Reference

1.    

ipr-mus LD50:230 mg/kg

     JMPCAS    Journal of Medicinal and Pharmaceutical Chemistry. 2 (1960),201.
2.    

ivn-mus LD50:100 mg/kg

     JMCMAR    Journal of Medicinal Chemistry. 23 (1980),1350.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by intravenous and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating vapors.

Specification

  2,6-Diethylphenol (1006-59-3) is also known as 4-06-00-03351 (Beilstein Handbook Reference) ; Phenol, 2,6-diethyl- .