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139409-34-0

Basic Information
CAS No.: 139409-34-0
Name: 2-BROMO-1H-INDOLE
Article Data: 22
Molecular Structure:
Molecular Structure of 139409-34-0 (2-BROMO-1H-INDOLE)
Formula: C8H6 Br N
Molecular Weight: 196.046
Synonyms: 2-Bromoindole
Density: 1.660
Boiling Point: 316.9°C at 760 mmHg
Flash Point: 145.5°C
PSA: 15.79000
LogP: 2.93040
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  • 2-Bromo-1H-indole CAS No.139409-34-0

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Chemistry

Molecular Structure of 2-Bromoindole (CAS NO.139409-34-0):

IUPAC Name: 2-Bromo-1H-indole 
Molecular Formula: C8H6BrN
Molecular Weight: 196.04 
Mol File: 139409-34-0.mol 
XLogP3: 3.5
H-Bond Donor: 1
H-Bond Acceptor: 0
Index of Refraction: 1.711
Molar Refractivity: 46.21 cm3
Molar Volume: 118 cm3
Surface Tension: 54.8 dyne/cm
Density: 1.66 g/cm3
Flash Point: 145.5 °C
Enthalpy of Vaporization: 53.61 kJ/mol
Boiling Point: 316.9 °C at 760 mmHg
Vapour Pressure: 0.000738 mmHg at 25 °C
Canonical SMILES: C1=CC=C2C(=C1)C=C(N2)Br
InChI: InChI=1S/C8H6BrN/c9-8-5-6-3-1-2-4-7(6)10-8/h1-5,10H
InChIKey: ZPRQXVPYQGBZON-UHFFFAOYSA-N

Specification

 2-Bromoindole (CAS NO.139409-34-0), its Synonym is 1H-Indole, 2-bromo- .