Phenanthrene,1-methyl-7-(1-methylethyl)- supplier

Name
RETENE
EINECS 207-597-9
CAS No. 483-65-8
Article Data50
CAS DataBase
Density 1.046 g/cm³
Solubility Insoluble in water
Melting Point 95-97 °C(lit.)
Formula C₁₈H₁₈
Boiling Point 391.998 °C at 760 mmHg
Molecular Weight 234.341
Flash Point 177.812 °C
Transport Information
Appearance Beige flakes
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Phenanthrene,7-isopropyl-1-methyl- (7CI,8CI);Retene (6CI);1-Methyl-7-(1-methylethyl)phenanthrene;1-Methyl-7-isopropylphenanthrene;7-Isopropyl-1-methylphenanthrene;NSC 26317;
PSA 0.00000
LogP 5.42480

Phenanthrene,1-methyl-7-(1-methylethyl)- Specification

The Phenanthrene,1-methyl-7-(1-methylethyl)-, with the CAS registry number 483-65-8, is also known as 7-Isopropyl-1-methylphenanthrene. This chemical's molecular formula is C₁₈H₁₈ and molecular weight is 234.34. What's more, its systematic name is 1-Methyl-7-(propan-2-yl)phenanthrene and its EINECS number is 207-597-9. Besides, it belongs to the product category of Aromatic Hydrocarbons (substituted) & Derivatives. The product is stable at common pressure and temperature, and it should be sealed and stored in a ventilated and dry place at common temperature.

Physical properties of Phenanthrene,1-methyl-7-(1-methylethyl)- are: (1)ACD/LogP: 6.49; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.494; (4)ACD/LogD (pH 7.4): 6.494; (5)ACD/BCF (pH 5.5): 50756.707; (6)ACD/BCF (pH 7.4): 50756.707; (7)ACD/KOC (pH 5.5): 81240.82; (8)ACD/KOC (pH 7.4): 81240.82; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.642; (13)Molar Refractivity: 80.948 cm³; (14)Molar Volume: 224.013 cm³; (15)Polarizability: 32.09×10^-24cm³; (16)Surface Tension: 41.225 dyne/cm; (17)Density: 1.046 g/cm³; (18)Flash Point: 177.812 °C; (19)Enthalpy of Vaporization: 61.662 kJ/mol; (20)Boiling Point: 391.998 °C at 760 mmHg; (21)XLogP3: 6.5; (22)Heavy Atom Count: 18; (23)Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=CC2=C1C=CC3=C2C=CC(=C3)C(C)C
(2)InChI: InChI=1S/C18H18/c1-12(2)14-7-10-17-15(11-14)8-9-16-13(3)5-4-6-18(16)17/h4-12H,1-3H3
(3)InChIKey: NXLOLUFNDSBYTP-UHFFFAOYSA-N

Product Name

RETENE

Phenanthrene,1-methyl-7-(1-methylethyl)- Specification

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