4-AMINOMETHYLINDOLE
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4-AMINOMETHYLINDOLE
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CAS No:
3468-18-6
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Formula:
C9H10N2
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Chemical Name:
4-AMINOMETHYLINDOLE
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Synonyms:
NSC131886;4-AMINOMETHYLINDOLE;CHEMBRDG-BB4003293;INDOLE-4-METHYLAMINE;1H-INDOLE-4-METHANAMINE;1H-Indol-4-ylmethanamine;(1H-Indol-4-ymetyl)amine;4-(Aminomethyl)indole95%;(1H-INDOL-4-YLMETHYL)AMINE;C-(1H-INDOL-4-YL)-METHYLAMINE
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CAS No:
Characteristics
41.8
0.9
A crystalline solid
1.2±0.1 g/cm3
132℃
335.6°C at 760 mmHg
183.3±8.1 °C
1.698
soluble in ethanol, dimethyl sulfoxide and dimethyl formamide.
Safety Information
IRRITANT
NONH for all modes of transport
36/37/38-41-37/38-22
26-36/37/39
Xi,Xn
P261-P280-P305 + P351 + P338
H302-H315-H318-H335
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-AMINOMETHYLINDOLE Use and Manufacturing
Preparation of C-(1H-indol-4-yl)-methylamineMethod B. 4-cynoindole (1.0 mmol) was dissolved in MeOH in a hydrogenator reaction flask, 10percent Pd/C (10 mg) was added and hydrogenator was shook at 40-42 psi overnight. Reaction mixture was carefully taken out from hydrogenator, filtered through celite and purified by column chromatography (EtOAc: MeOH; 9.5: 0.5) with few drops of aqueous ammonia.
Reactant for preparation of dopamine receptor antagonists 1 Reactant for preparation of high-affinity ligands to α2δ subunit of voltage-gated calcium channels 2
Computed Properties
Molecular Weight:146.19
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:146.084398327
Monoisotopic Mass:146.084398327
Topological Polar Surface Area:41.8
Heavy Atom Count:11
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes