Cas no 14533-78-9 (1H-Pyrrole-2-carboxaldehyde, 5-methyl-3-phenyl-)
14533-78-9 structure
Product Name:1H-Pyrrole-2-carboxaldehyde, 5-methyl-3-phenyl-
CAS No:14533-78-9
MF:C12H11NO
MW:185.221843004227
CID:1318979
Update Time:2024-08-18
1H-Pyrrole-2-carboxaldehyde, 5-methyl-3-phenyl- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrrole-2-carboxaldehyde, 5-methyl-3-phenyl-
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- Inchi: 1S/C12H11NO/c1-9-7-11(12(8-14)13-9)10-5-3-2-4-6-10/h2-8,13H,1H3
- InChI Key: ZADPHPGSOZOSLP-UHFFFAOYSA-N
- SMILES: N1C(C)=CC(C2=CC=CC=C2)=C1C=O
Computed Properties
- Exact Mass: 185.08413
Experimental Properties
- Density: 1.150±0.06 g/cm3(Predicted)
- Boiling Point: 363.7±42.0 °C(Predicted)
- PSA: 32.86
- pka: 15.67±0.50(Predicted)
1H-Pyrrole-2-carboxaldehyde, 5-methyl-3-phenyl- Related Literature
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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