Basic Information | Post buying leads | Suppliers |
Name |
1H-Indol-3-ylmethylazanium |
EINECS | N/A |
CAS No. | 296775-93-4 | Density | 1.2860 (rough estimate) |
PSA | 116.41000 | LogP | 1.48250 |
Solubility | N/A | Melting Point |
203 °C |
Formula | C9H11N2+ | Boiling Point | 335.6 °C at 760 mmHg |
Molecular Weight | 236.227 | Flash Point | 183.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 45 | Risk Codes | 25 |
Molecular Structure | Hazard Symbols | Xi,T | |
Synonyms |
3-(Aminomethyl)indole oxalate; |
The 1H-Indol-3-ylmethylazanium, with the CAS registry number 296775-93-4, is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H11N2+.
The characteristics of 1H-Indol-3-ylmethylazanium are as followings: (1)ACD/LogP: 1.01; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 4.93 Å2; (7)Flash Point: 183.3 °C; (8)Enthalpy of Vaporization: 57.87 kJ/mol; (9)Boiling Point: 335.6 °C at 760 mmHg; (10)Vapour Pressure: 0.000118 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cccc2c1c(cn2)C[NH3+]
(2)InChI: InChI=1/C9H10N2/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5,10H2/p+1
(3)InChIKey: JXYGLMATGAAIBU-IKLDFBCSAI