Cas no 88097-30-7 (Pyrimidine, 1,4,5,6-tetrahydro-2-nonyl-)
88097-30-7 structure
Product Name:Pyrimidine, 1,4,5,6-tetrahydro-2-nonyl-
CAS No:88097-30-7
MF:C13H26N2
MW:210.358943462372
CID:645243
PubChem ID:13172834
Update Time:2025-04-19
Pyrimidine, 1,4,5,6-tetrahydro-2-nonyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 1,4,5,6-tetrahydro-2-nonyl-
- 2-nonyl-1,4,5,6-tetrahydropyrimidine
- 88097-30-7
- DTXSID40524634
-
- Inchi： 1S/C13H26N2/c1-2-3-4-5-6-7-8-10-13-14-11-9-12-15-13/h2-12H2,1H3,(H,14,15)
- InChI Key： HDFGUXYLJHRCLG-UHFFFAOYSA-N
- SMILES： N1CCCN=C1CCCCCCCCC
Computed Properties
- Exact Mass: 210.209598838g/mol
- Monoisotopic Mass: 210.209598838g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 8
- Complexity: 175
- 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: 3.7
- Topological Polar Surface Area: 24.4?2
Pyrimidine, 1,4,5,6-tetrahydro-2-nonyl- Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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