| Identification | Back Directory | [Name]
1H-PYRROLO[2,3-B]PYRIDIN-5-YLAMINE | [CAS]
100960-07-4 | [Synonyms]
5-AMINO-7-AZAINDOLE
3-B]PYRIDIN-5-YLAMINE
5-AMino-7-aza-1H-indole
5-Amino-7-azaindole,97%
1H-PYRROLO[2,3-B]PYRIDIN-5-AMINE
1H-PYRROLO[2,3-B]PYRIDINE-5-AMINE
5-Amino-1H-pyrrolo[2,3-b]pyridine
1H-PYRROLO[2,3-B]PYRIDIN-5-YLAMINE
1H-Pyrrolo[2,3-b]pyridine,5-amino-(6CI)
1H-PYRROLO[2,3-B]PYRIDIN-5-YLAMINE ISO 9001：2015 REACH
1H-Pyrrolo[2,3-b]pyridin-5-ylaMine | [Molecular Formula]
C7H7N3 | [MDL Number]
MFCD06659683 | [MOL File]
100960-07-4.mol | [Molecular Weight]
133.15 |
| Chemical Properties | Back Directory | [Melting point ]
128-129°C | [Boiling point ]
361.7±35.0 °C(Predicted) | [density ]
1.41±0.1 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [form ]
Solid | [pka]
8.28±0.20(Predicted) | [color ]
Yellow to yellow/brown | [Sensitive ]
Light Sensitive | [InChI]
InChI=1S/C7H7N3/c8-6-3-5-1-2-9-7(5)10-4-6/h1-4H,8H2,(H,9,10) | [InChIKey]
PLWBENCHEUFMTN-UHFFFAOYSA-N | [SMILES]
C12NC=CC1=CC(N)=CN=2 | [CAS DataBase Reference]
100960-07-4 |
| Hazard Information | Back Directory | [Chemical Properties]
Brown crystalline powder | [Synthesis]
5-Amino-7-azaindole is synthesised using 5-Nitro-7-azaindole as a raw material by chemical reaction. The specific synthesis steps are as follows:
To a stirred solution of 5nitro7azaindoie (500 rng, 3.07 rnmol) in methanol (125 rnL) under nitrogen atmosphere was added 10percent Pd/C (326 mg, 0.306 rnmol). The reaction was placed under an atmosphere of hydrogen gas and stirred at 20 °C overnight. The suspension was filtered through a pad of Celite? 545, the resulting filter cake was washed with MeOH, and the combined organicphases concentrated in vaeuo to afford 5-Amino-7-azaindole compound (408 mg, 100percent). MS (ES1): mass calcd. for C7HN3 133.1, rn/z found 133.9 [M+H]t. ‘H NMR (300 MHz, DMSO-d6) ? 11.04 (s, 1H), 7.70 (d, J= 2.4 Hz, iH, 7.27 —7.18 (m, 1ff), 7.08 (d, J= 2.3 Hz, IH), 6.22 —6.06 (m, 1H), 4.62 (s, 2H).
 | [References]
[1] Patent: WO2016/176460, 2016, A1. Location in patent: Page/Page column 98; 99
[2] Patent: US2007/112020, 2007, A1. Location in patent: Page/Page column 36
[3] Patent: EP2070928, 2009, A1. Location in patent: Page/Page column 92
[4] Synthesis, 2005, # 15, p. 2503 - 2506
[5] Patent: WO2008/28617, 2008, A1. Location in patent: Page/Page column 41; 27 |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn | [Risk Statements ]
22-36 | [Safety Statements ]
26-24/25 | [WGK Germany ]
3 | [HazardClass ]
IRRITANT | [HS Code ]
29339900 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Irrit. 2 |
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