Cas no 117517-22-3 (2,4-Pyridinedicarboxamide,N2,N4-diethyl-)
117517-22-3 structure
Product Name:2,4-Pyridinedicarboxamide,N2,N4-diethyl-
CAS No:117517-22-3
MF:C11H15N3O2
MW:221.255702257156
CID:140857
PubChem ID:3081128
Update Time:2025-04-19
2,4-Pyridinedicarboxamide,N2,N4-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pyridinedicarboxamide,N2,N4-diethyl-
- 2-(diethylcarbamoyl)pyridine-4-carboxylic acid
- pyridine-2,4-dicarboxylic-diethylamide
- 2,4-Pyridinedicarboxamide, N,N'-diethyl-
- N,N'-diethylpyridine-2,4-dicarboxamide
- S 0885
- S-0885
- N-Ethyl-2-(ethylcarbamoyl)pyridine-4-carboximidic acid
- SCHEMBL4353042
- DTXSID40922454
- 117517-22-3
- 2-N,4-N-diethylpyridine-2,4-dicarboxamide
-
- Inchi： 1S/C11H15N3O2/c1-3-12-10(15)8-5-6-14-9(7-8)11(16)13-4-2/h5-7H,3-4H2,1-2H3,(H,12,15)(H,13,16)
- InChI Key： TWTBKLRCHALMQA-UHFFFAOYSA-N
- SMILES： O=C(C1C=CN=C(C(NCC)=O)C=1)NCC
Computed Properties
- Exact Mass: 221.11655
- Monoisotopic Mass: 221.116427
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 256
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 71.1
- XLogP3: 0.5
Experimental Properties
- Density: 1.126
- Boiling Point: 491.7°Cat760mmHg
- Flash Point: 251.2°C
- Refractive Index: 1.532
- PSA: 71.09
2,4-Pyridinedicarboxamide,N2,N4-diethyl- Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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