Cas no 140201-08-7 (3-Pyridinecarboxylicacid, 1,4-dihydro-1-methyl-)
140201-08-7 structure
Product Name:3-Pyridinecarboxylicacid, 1,4-dihydro-1-methyl-
CAS No:140201-08-7
MF:C7H9NO2
MW:139.151861906052
CID:157216
PubChem ID:126572
Update Time:2025-04-19
3-Pyridinecarboxylicacid, 1,4-dihydro-1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxylicacid, 1,4-dihydro-1-methyl-
- 1-methyl-4H-pyridine-3-carboxylic acid
- 1,4-Dihydrotrigonelline
- 1-methyl-1,4-dihydropyridine-3-carboxylic acid
- 3-Pyridinecarboxylic acid, 1,4-dihydro-1-methyl-
- AKOS006379799
- DTXSID40161260
- 1,4-dihydro-N-methylnicotinic acid
- 140201-08-7
-
- Inchi： 1S/C7H9NO2/c1-8-4-2-3-6(5-8)7(9)10/h2,4-5H,3H2,1H3,(H,9,10)
- InChI Key： BCFPLUJRJLEPGV-UHFFFAOYSA-N
- SMILES： OC(C1=CN(C)C=CC1)=O
Computed Properties
- Exact Mass: 139.063
- Monoisotopic Mass: 139.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 206
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 0.6
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- Density: 1.217
- Boiling Point: 259.6°Cat760mmHg
- Flash Point: 110.8°C
- Refractive Index: 1.554
3-Pyridinecarboxylicacid, 1,4-dihydro-1-methyl- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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