M8279
2-Methylanthracene
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About This Item
Empirical Formula (Hill Notation):
C15H12
CAS Number:
Molecular Weight:
192.26
Beilstein:
2042447
EC Number:
MDL number:
UNSPSC Code:
12352103
mp
204-206 °C (lit.)
SMILES string
Cc1ccc2cc3ccccc3cc2c1
InChI
1S/C15H12/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-10H,1H3
InChI key
GYMFBYTZOGMSQJ-UHFFFAOYSA-N
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Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Aquatic Acute 1
Storage Class Code
13 - Non Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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A A Toropov et al.
European journal of medicinal chemistry, 43(4), 714-740 (2007-07-17)
Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors. Statistical characteristics of the best model (vitamins) are the
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