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Phenanthrene,3,6-dimethyl- (1576-67-6)

Identification
Name:Phenanthrene,3,6-dimethyl-
Synonyms:3,6-Dimethylphenanthrene;NSC 60070;
CAS:1576-67-6
EINECS: 216-409-4
Molecular Formula: C16H14
Molecular Weight: 206.2824
InChI: InChI=1/C16H14/c1-11-3-5-13-7-8-14-6-4-12(2)10-16(14)15(13)9-11/h3-10H,1-2H3
Molecular Structure: (C16H14) 3,6-Dimethylphenanthrene;NSC 60070;
Properties
Transport:UN1230 3/
Density:1.084 g/cm3
Refractive index:1.676
Specification:

The cas register number of 3,6-Dimethylphenanthrene is 1576-67-6. It also can be called as Phenanthrene,3,6-dimethyl- and the IUPAC Name about this chemical is 3,6-dimethylphenanthrene. It belongs to the following product categories, such as Highly Purified Reagents, Other Categories, Refined Products by Sublimation and so on.

Physical properties about 3,6-Dimethylphenanthrene are: (1)ACD/LogP: 5.60; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.6; (4)ACD/LogD (pH 7.4): 5.6; (5)ACD/BCF (pH 5.5): 10613.87; (6)ACD/BCF (pH 7.4): 10613.87; (7)ACD/KOC (pH 5.5): 26503.9; (8)ACD/KOC (pH 7.4): 26503.9; (9)Index of Refraction: 1.676; (10)Molar Refractivity: 71.58 cm3; (11)Molar Volume: 190.2 cm3; (12)Polarizability: 28.37x10-24cm3; (13)Surface Tension: 44.1 dyne/cm; (14)Enthalpy of Vaporization: 58.5 kJ/mol; (15)Vapour Pressure: 3.89E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation, in contact with skin and if swallowed and it is highly flammable, it has danger of very serious irreversible effects. When you are using it, wear suitable protective clothing and gloves, please keep away from sources of ignition, and also keep container tightly closed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice and in case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(C=C1)C=CC3=C2C=C(C=C3)C
(2)InChI: InChI=1S/C16H14/c1-11-3-5-13-7-8-14-6-4-12(2)10-16(14)15(13)9-11/h3-10H,1-2H3
(3)InChIKey: OMIBPZBOAJFEJS-UHFFFAOYSA-N

Safety Data
Hazard Symbols T: Toxic F: Flammable