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58258-65-4

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Basic Information
CAS No.: 58258-65-4
Name: 1,7-Dibromonaphthalene
Molecular Structure:
Molecular Structure of 58258-65-4 (1,7-Dibromonaphthalene)
Formula: C10H6Br2
Molecular Weight: 285.966
Synonyms: 1,7-Dibromonaphthalene
Density: 1.834 g/cm3
Boiling Point: 339.132 °C at 760 mmHg
Flash Point: 184.678 °C
PSA: 0.00000
LogP: 4.36480
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Specification

With the CAS registry number 58258-65-4, the systematic name of 1,7-Dibromonaphthalene is 1,7-dibromonaphthalene. In addition, its molecular formula is C10H6Br2 and molecular weight is 285.96.

The other characteristics of 1,7-Dibromonaphthalene can be summarized as: (1)ACD/LogP: 4.88; (2)# of Rule of 5 Violations: 0; (3)H bond acceptors: 0; (4)H bond donors: 0; (5)Freely Rotating Bonds: 0; (6)Nominal mass: 284; (7)Average mass: 285.9626; (8)Monoisotopic mass: 283.88361; (9)Polar Surface Area: 0 Å2; (10)Index of Refraction: 1.688; (11)Molar Refractivity: 59.476 cm3; (12)Molar Volume: 155.919 cm3; (13)Polarizability: 23.578×10-24cm3; (14)Surface Tension: 48.799 dyne/cm; (15)Density: 1.834 g/cm3; (16)Flash Point: 184.678 °C; (17)Enthalpy of Vaporization: 55.948 kJ/mol; (18)Boiling Point: 339.132 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Brc1c2c(ccc1)ccc(Br)c2
(2)InChI:InChI=1/C10H6Br2/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h1-6H
(3)InChIKey:LTFFDNPPMQALBV-UHFFFAOYAG
(4)Std. InChI:InChI=1S/C10H6Br2/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h1-6H
(5)Std. InChIKey:LTFFDNPPMQALBV-UHFFFAOYSA-N