1H-Pyrrolo[3,4-c]pyridin-3(2H)-one
- Product Name
- 1H-Pyrrolo[3,4-c]pyridin-3(2H)-one
- CAS No.
- 40107-95-7
- Chemical Name
- 1H-Pyrrolo[3,4-c]pyridin-3(2H)-one
- Synonyms
- 1,2-Dihydro-3H-pyrrolo[3,...;1H-Pyrrolo[3,4-c]pyridin-3(2H);1H,2H-pyrrolo[3,4-c]pyridin-3-one;1H-Pyrrolo[3,4-c]pyridin-3(2H)-one;1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one;1,2-dihydropyrrolo[3,4-c]pyridin-3-one;1H-pyridine[3,4-C]benzopyridine-3(2H)-one;1,2-Dihydro-3H-pyrrolo[3,4-c]pyridin-3-one;3H-Pyrrolo[3,4-c]pyridin-3-one, 1,2-dihydro-;1. 1,2-Dihydro-3H-pyrrolo[3,4-c]pyridin-3-one
- CBNumber
- CB42503448
- Molecular Formula
- C7H6N2O
- Formula Weight
- 134.14
- MOL File
- 40107-95-7.mol
1H-Pyrrolo[3,4-c]pyridin-3(2H)-one Property
- Boiling point:
- 407.0±34.0 °C(Predicted)
- Density
- 1.286±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 12.37±0.20(Predicted)
- Appearance
- Yellow to brown Solid
- InChI
- InChI=1S/C7H6N2O/c10-7-6-4-8-2-1-5(6)3-9-7/h1-2,4H,3H2,(H,9,10)
- InChIKey
- ROSODFDWJFAKQI-UHFFFAOYSA-N
- SMILES
- C1=NC=CC2CNC(=O)C1=2
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P270Do not eat, drink or smoke when using this product.
P271Use only outdoors or in a well-ventilated area.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P312Call a POISON CENTER or doctor/physician if you feel unwell.
P321Specific treatment (see … on this label).
P330Rinse mouth.
P332+P313IF SKIN irritation occurs: Get medical advice/attention.
P337+P313IF eye irritation persists: Get medical advice/attention.
P362Take off contaminated clothing and wash before reuse.
P403+P233Store in a well-ventilated place. Keep container tightly closed.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- D679753
- Product name
- 1,2-Dihydro-3H-pyrrolo[3,4-c]pyridin-3-one
- Packaging
- 10mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- 4H48-1-AW
- Product name
- 1,2-Dihydro-3H-pyrrolo[3,4-c]pyridin-3-one
- Packaging
- 1g
- Price
- $430
- Updated
- 2021/12/16
- Product number
- CHM1052186
- Product name
- 1H,2H,3H-PYRROLO[3,4-C]PYRIDIN-3-ONE
- Purity
- 95.00%
- Packaging
- 5MG
- Price
- $457.71
- Updated
- 2021/12/16
- Product number
- 48R0809
- Product name
- 1,2-Dihydro-pyrrolo[3,4-c]pyridin-3-one
- Purity
- 95%
- Packaging
- 100mg
- Price
- $117
- Updated
- 2021/12/16
- Product number
- CM107943
- Product name
- 1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one
- Purity
- 95%+
- Packaging
- 1g
- Price
- $295
- Updated
- 2021/12/16
1H-Pyrrolo[3,4-c]pyridin-3(2H)-one Chemical Properties,Usage,Production
Synthesis
4664-01-1
40107-95-7
General procedure: 3,4-pyridinedicarboximide (0.40 g, 2.7 mmol, 1.0 eq.) was dissolved in acetic acid (12 mL) and zinc powder (0.78 g, 11.9 mmol, 4.4 eq.) was added. The suspension was heated to reflux for 24 hours. After completion of the reaction, it was cooled to room temperature and the mixture was filtered through a diatomaceous earth pad. The filtrate was concentrated under reduced pressure and the residue was dissolved in dichloromethane (CH2Cl2). Anhydrous calcium chloride (CaCl2) was added to this solution and the insoluble material was removed by filtration. The filtrate was concentrated again under reduced pressure and the resulting crude product was purified by column chromatography using ethyl acetate/methanol (95:5, v/v) as eluent. The target fraction was collected, concentrated and crystallized from ethanol to give 1H-pyrrolo[3,4-c]pyridin-3(2H)-one (0.061 g, 17% yield) as a yellow solid. Product characterization: melting point 190-193 °C (decomposition); 1H NMR (300 MHz, DMSO-d6) δ 8.84 (s, 1H), 8.70 (br d, 2H), 7.62 (d, J = 5.5 Hz, 1H), 4.42 (s, 2H); 13C NMR (75 MHz, DMSO-d6) δ 169.1, 153.3 , 151.6, 145.3, 129.0, 119.9, 45.2; GC-MS m/z 134 (M+); IR (KBr) 2856, 1728, 1692, 1455, 1206, 1026 cm-1. Calculated elemental values (C7H6N2O): C, 62.68; H, 4.51; N, 20.88. measured values Calculated values for elemental analysis (C7H6N2O): C, 62.68; H, 4.51; N, 20.88.
References
[1] European Journal of Medicinal Chemistry, 2012, vol. 55, p. 58 - 66,9
[2] Patent: WO2005/103003, 2005, A2. Location in patent: Page/Page column 106
1H-Pyrrolo[3,4-c]pyridin-3(2H)-one Preparation Products And Raw materials
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