Cas no 160237-80-9 (Pyrimidine,2-chloro-5-octyl-)
Pyrimidine,2-chloro-5-octyl- structure
Product Name:Pyrimidine,2-chloro-5-octyl-
CAS No:160237-80-9
MF:C12H19ClN2
MW:226.745661973953
CID:109458
PubChem ID:53424473
Update Time:2025-04-18
Pyrimidine,2-chloro-5-octyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,2-chloro-5-octyl-
- 2-chloro-5-octylpyrimidine
- DTXSID10698513
- 160237-80-9
-
- Inchi： 1S/C12H19ClN2/c1-2-3-4-5-6-7-8-11-9-14-12(13)15-10-11/h9-10H,2-8H2,1H3
- InChI Key： PMJWHOKKOIBOPT-UHFFFAOYSA-N
- SMILES： ClC1=NC=C(C=N1)CCCCCCCC
Computed Properties
- Exact Mass: 226.12387
- Monoisotopic Mass: 226.1236763g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 145
- 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: 5.2
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
Pyrimidine,2-chloro-5-octyl- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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5. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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