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3,5-Dimethylphenol
[CAS# 50356-23-5]

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Identification
Name 3,5-Dimethylphenol
Synonyms 3,5-Dimethyl Phenol; Ncgc00091574-01; 3,5-Dimethylphenol Solution
Molecular Structure CAS#: 50356-23-5, 3,5-Dimethylphenol
Molecular Formula C8H10O
Molecular Weight 122.17
CAS Registry Number 50356-23-5
SMILES C1=C(C)C=C(C=C1C)O
InChI 1S/C8H10O/c1-6-3-7(2)5-8(9)4-6/h3-5,9H,1-2H3
InChIKey TUAMRELNJMMDMT-UHFFFAOYSA-N
Properties
Density 1.12 (Expl.)
1.0±0.1g/cm3 (Cal.)
Melting point 64°C (Expl.)
Boiling point 221.689°C at 760 mmHg (Cal.)
222°C (Expl.)
Flash point 109°C (Expl.)
92.3±7.2°C (Cal.)
Safety Data
Safety Code S1/2;S26;S28;S36/37/39;S45  Details
Risk Code R24/25;R34  Details
Hazard Symbol symbol  T  Details
Transport Information UN2261
Safety Description DANGER: POISON, CORROSIVE, burns eyes, skin, lungs
DANGER: POISON, CORROSIVE, irritates eyes, skin, lungs
References
(1) Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493
Market Analysis Reports
List of Reports Available for 3,5-Dimethylphenol
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