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78573-85-0

Basic Information
CAS No.: 78573-85-0
Name: 1-Bromo-7-phenylheptane
Article Data: 10
Molecular Structure:
Molecular Structure of 78573-85-0 (1-Bromo-7-phenylheptane)
Formula: C13H19 Br
Molecular Weight: 255.198
Synonyms: Heptane,1-bromo-7-phenyl- (6CI); (7-Bromoheptyl)benzene; 1-Bromo-7-phenylheptane;7-Phenylheptyl bromide
Density: 1.17g/cm3
Boiling Point: 92-94°C
Flash Point: 165.2°C
Hazard Symbols:
Safety:
Hazard Codes Xi
Hazard Note Irritant
PSA: 0.00000
LogP: 4.57450
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Chemistry

Molecular Structure of 1-Bromo-7-phenylheptane (CAS No.78573-85-0):
 
Molecular Formula: C13H19Br
Molecular Weight: 255.194
CAS No: 78573-85-0
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 7
Polar Surface Area: 0 Å2
Index of Refraction: 1.524
Molar Refractivity: 66.69 cm3
Molar Volume: 217.9 cm3
Surface Tension: 36.2 dyne/cm
Density: 1.17 g/cm3
Flash Point: 165.2 °C
Enthalpy of Vaporization: 53.44 kJ/mol
Boiling Point: 315.4 °C at 760 mmHg
Vapour Pressure: 0.000813 mmHg at 25°C
IUPAC Name: 7-Bromoheptylbenzene
InChI: InChI=1/C13H19Br/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,1-3,5,8-9,12H2
InChIKey: ASLQYSAHLPRDAY-UHFFFAOYAL
Std. InChI: InChI=1S/C13H19Br/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,1-3,5,8-9,12H2
Std. InChIKey: ASLQYSAHLPRDAY-UHFFFAOYSA-N

Safety Profile

Hazard Codes: IrritantXi
Hazard Note: Irritant

Specification

   1-Bromo-7-phenylheptane (CAS No.78573-85-0), its synonyms are (7-Bromheptyl)benzol ; (7-Bromoheptyl)benzene ; Benzene, (7-bromoheptyl)- .