2-Phenyldecane - CAS 4537-13-7
Catalog: |
BB054320 |
Product Name: |
2-Phenyldecane |
CAS: |
4537-13-7 |
Synonyms: |
(2-Decyl)benzene; (1-Methylnonyl)benzene; Benzene, (1-methylnonyl)-; Decane, 2-phenyl-; 2-Decanylbenzene; 2-Decanylbenzol |
IUPAC Name: | decan-2-ylbenzene |
Molecular Weight: | 218.38 |
Molecular Formula: | C16H26 |
Canonical SMILES: | CCCCCCCCC(C)C1=CC=CC=C1 |
InChI: | InChI=1S/C16H26/c1-3-4-5-6-7-9-12-15(2)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3 |
InChI Key: | DDTJIQUCOLHYDL-UHFFFAOYSA-N |
Boiling Point: | 289.1±7.0°C at 760 mmHg |
Melting Point: | -0.5°C |
Purity: | ≥95% |
Density: | 0.9±0.1 g/mL |
Solubility: | Soluble in Chloroform (Slightly), DMF, Ethyl Acetate, Methanol (Slightly), THF |
Appearance: | Colorless Oily Matter |
Storage: | Store at -20°C under inert atmosphere |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.203450829 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.203450829 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 6.8 |
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