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1,3-Dimethylnaphthalene
[CAS# 575-41-7]

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Identification
Classification Chemical reagent >> Organic reagent >> Polycyclic compound
Name 1,3-Dimethylnaphthalene
Synonyms D170208_Aldrich; Inchi=1/C12h12/C1-9-7-10(2)12-6-4-3-5-11(12)8-9/H3-8H,1-2H; 36914_Riedel
Molecular Structure CAS#: 575-41-7, 1,3-Dimethylnaphthalene
Molecular Formula C12H12
Molecular Weight 156.23
CAS Registry Number 575-41-7
EINECS 209-384-6
SMILES C1=CC=CC2=CC(=CC(=C12)C)C
InChI 1S/C12H12/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h3-8H,1-2H3
InChIKey QHJMFSMPSZREIF-UHFFFAOYSA-N
Properties
Density 1.001g/cm3 (Cal.)
Boiling point 263.711°C at 760 mmHg (Cal.)
Flash point 109.444°C (Cal.)
Safety Data
SDS Available
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 1,3-Dimethylnaphthalene
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