Cas no 114153-80-9 (5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol)
![5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol structure](https://ossimg.kuujia.com/scimg/114500/114153-80-9x500.png)
114153-80-9 structure
Product Name:5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol
CAS No:114153-80-9
MF:C9H15ClN4O
MW:230.694600343704
CID:2612428
PubChem ID:293303
Update Time:2025-04-21
5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol Chemical and Physical Properties
Names and Identifiers
-
- 5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol
- DTXSID90303658
- NSC159711
- NSC-159711
- 114153-80-9
-
- Inchi： 1S/C9H15ClN4O/c10-8-7(11)9(14-6-13-8)12-4-2-1-3-5-15/h6,15H,1-5,11H2,(H,12,13,14)
- InChI Key： FVSTUIFFPGEDSV-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=NC=N1)NCCCCCO)N
Computed Properties
- Exact Mass: 230.0934388Da
- Monoisotopic Mass: 230.0934388Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 172
- 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: 1.2
- Topological Polar Surface Area: 84.1?2
5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
114153-80-9 (5-[(5-amino-6-chloropyrimidin-4-yl)amino]pentan-1-ol) Related Products
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