Cas no 1342906-72-2 (Methyl 3-(benzyloxy)-4-bromo-6-methylpicolinate)
1342906-72-2 structure
Product Name:Methyl 3-(benzyloxy)-4-bromo-6-methylpicolinate
CAS No:1342906-72-2
MF:C15H14BrNO3
MW:336.18056344986
CID:1092139
PubChem ID:72942083
Update Time:2025-04-20
Methyl 3-(benzyloxy)-4-bromo-6-methylpicolinate Chemical and Physical Properties
Names and Identifiers
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- Methyl 3-(benzyloxy)-4-bromo-6-methylpicolinate
- methyl 4-bromo-6-methyl-3-phenylmethoxypyridine-2-carboxylate
- Methyl3-(benzyloxy)-4-bromo-6-methylpicolinate
- 1342906-72-2
-
- Inchi: 1S/C15H14BrNO3/c1-10-8-12(16)14(13(17-10)15(18)19-2)20-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
- InChI Key: LVGHDUWLRJIZCK-UHFFFAOYSA-N
- SMILES: BrC1C=C(C)N=C(C(=O)OC)C=1OCC1C=CC=CC=1
Computed Properties
- Exact Mass: 335.01571g/mol
- Monoisotopic Mass: 335.01571g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 320
- 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: 3.6
- Topological Polar Surface Area: 48.4?2
Methyl 3-(benzyloxy)-4-bromo-6-methylpicolinate Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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