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CAS No.: | 174854-93-4 |
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Name: | 4-Aminoindole |
Molecular Structure: | |
Formula: | C8H8N2.ClH |
Molecular Weight: | 168.62 |
Synonyms: | 1H-indol-4-amine hydrochloride (1:1); |
Boiling Point: | 372.4 °C at 760 mmHg |
Flash Point: | 179 °C |
PSA: | 41.81000 |
LogP: | 3.13330 |
The CAS registry number of 4-Aminoindole hydrochloride is 174854-93-4. The systematic name is 1H-indol-4-amine hydrochloride (1:1). In addition, the molecular formula is C8H8N2.ClH and the molecular weight is 168.62. What's more, it should be stored in a cool and dry place.
Physical properties about 4-Aminoindole hydrochloride are: (1)ACD/LogP: 0.86; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 41.81 Å2; (7)Flash Point: 179 °C; (8)Enthalpy of Vaporization: 63.17 kJ/mol; (9)Boiling Point: 372.4 °C at 760 mmHg; (10)Vapour Pressure: 6.6E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Nc1cccc2nccc12
(2)InChI: InChI=1/C8H8N2.ClH/c9-7-2-1-3-8-6(7)4-5-10-8;/h1-5,10H,9H2;1H
(3)InChIKey: RRDMEBTXVSZFJA-UHFFFAOYAZ