Naphthalene,6-bromo-1,2,3,4-tetrahydro-1,1,4,4-tetramethyl- (27452-17-1)

The 6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene, with the CAS registry number 27452-17-1, is also known as 6-Bromo-1,1,4,4-tetramethyl-1. And 6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene belongs to the product categories of Halides and Fused Ring Systems. This chemical's molecular formula is C₁₄H₁₉Br and molecular weight is 267.2. What's more, both its IUPAC name and systematic name are the same which is called 6-Bromo-1,1,4,4-tetramethyl-2,3-dihydronaphthalene.

Physical properties about this chemical are:(1) ACD/LogP: 7.10; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): 7.097; (4) ACD/LogD (pH 7.4): 7.097; (5) ACD/BCF (pH 5.5): 145694; (6) ACD/BCF (pH 7.4): 145694; (7) ACD/KOC (pH 5.5): 172810; (8) ACD/KOC (pH 7.4): 172810; (9) (#H bond acceptors: 0; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 0; (12) Polar Surface Area: 0 Å²; (13) Index of Refraction: 1.517; (14) Molar Refractivity: 69.372 cm³; (15) Molar Volume: 229.276 cm³; (16) Melting Point: 34 °C; (17) Surface Tension: 33.144 dyne/cm; (18) Density: 1.165 g/cm³; (19) Flash Point: 126.631 °C; (20) Enthalpy of Vaporization: 51.159 kJ/mol; (21) Boiling Point: 293.372 °C at 760 mmHg; (22) Vapour Pressure: 0.003 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health if inhalation, in contact with skin and swallowed. It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. Do not breathe gas/fumes/vapour/spray. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: CC1(CCC(C2=C1C=CC(=C2)Br)(C)C)C
(2) InChI: InChI=1S/C14H19Br/c1-13(2)7-8-14(3,4)12-9-10(15)5-6-11(12)13/h5-6,9H,7-8H2,1-4H3
(3) InChIKey: NLOOVMVNNNYLFS-UHFFFAOYSA-N