Cas no 6027-10-7 (Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide)
6027-10-7 structure
Product Name:Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide
CAS No:6027-10-7
MF:C9H16BrNO2
MW:250.132842063904
CID:951513
PubChem ID:201460
Update Time:2025-04-19
Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide Chemical and Physical Properties
Names and Identifiers
-
- Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide
- NA 217; NA 217 (pharmaceutical); Ethyl 1,2,5,6-tetrahydro-1-methyl-3-pyridinecarboxylate hydrobromide; 3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-, ethyl ester, hydrobromide; AC1L46HJ; NSC522026; NSC-522026; LS-131042; ethyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate hydrobromide;
- Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, ethyl ester, hydrobromide
- 3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-, ethyl ester, hydrobromide
- DS-010946
- NSC-522026
- Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, ethyl ester, hydrobromide (8CI)
- DTXSID80209019
- NSC 522026
- Ethyl 1,2,5,6-tetrahydro-1-methyl-3-pyridinecarboxylate hydrobromide
- NSC522026
- NA 217
- NA 217 (pharmaceutical)
- 6027-10-7
-
- Inchi： 1S/C9H15NO2.BrH/c1-3-12-9(11)8-5-4-6-10(2)7-8;/h5H,3-4,6-7H2,1-2H3;1H
- InChI Key： LNCZTSJVJMBYFM-UHFFFAOYSA-N
- SMILES： CCOC(C1CN(C)CCC=1)=O.Br
Computed Properties
- Exact Mass: 249.03648
- Monoisotopic Mass: 169.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 199
- 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
- XLogP3: 0.7
- Topological Polar Surface Area: 29.5A^2
Experimental Properties
- Density: 1.038
- Boiling Point: 228.8oC at 760 mmHg
- Flash Point: 86.2oC
- PSA: 29.54
- LogP: 1.70740
Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
6027-10-7 (Ethyl 1-methyl-3,6-dihydro-2h-pyridine-5-carboxylate;hydrobromide) Related Products
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