Cas no 255-82-3 (Pyrido[1,2-a]pyrimidin-5-ium(8CI,9CI))
255-82-3 structure
Product Name:Pyrido[1,2-a]pyrimidin-5-ium(8CI,9CI)
Pyrido[1,2-a]pyrimidin-5-ium(8CI,9CI) Chemical and Physical Properties
Names and Identifiers
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- Pyrido[1,2-a]pyrimidin-5-ium(8CI,9CI)
- pyrido[1,2-a]pyrimidin-5-ium
- 1-Azaquinolizinium
- 1-Azaquinolizinium cation
- DTXSID40357424
- AKOS022141618
- 255-82-3
- SCHEMBL10995686
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- Inchi: 1S/C8H7N2/c1-2-6-10-7-3-5-9-8(10)4-1/h1-7H/q+1
- InChI Key: IVTFWANDUTYGRQ-UHFFFAOYSA-N
- SMILES: [N+]12=CC=CN=C1C=CC=C2
Computed Properties
- Exact Mass: 131.06101
- Monoisotopic Mass: 131.060923232g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 114
- 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: 2.1
- Topological Polar Surface Area: 17?2
Experimental Properties
- PSA: 16.99
Pyrido[1,2-a]pyrimidin-5-ium(8CI,9CI) Related Literature
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Yuan Chen,Xue-Rui Wei,Ru Sun,Yu-Jie Xu,Jian-Jeng Ge Anal. Methods 2019 11 3523
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