Cas no 7251-60-7 (2-Pyrimidinamine,4-chloro-6-(propylthio)-)
7251-60-7 structure
Product Name:2-Pyrimidinamine,4-chloro-6-(propylthio)-
CAS No:7251-60-7
MF:C7H10ClN3S
MW:203.692398548126
CID:574337
PubChem ID:237629
Update Time:2025-04-19
2-Pyrimidinamine,4-chloro-6-(propylthio)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrimidinamine,4-chloro-6-(propylthio)-
- 4-chloro-6-propylsulfanylpyrimidin-2-amine
- 2-Amino-4-chlor-6-propylmercapto-pyrimidin
- 4-chloro-6-(propylsulfanyl)pyrimidin-2-amine
- 4-chloro-6-propylsulfanyl-pyrimidin-2-ylamine
- AC1L5Z75
- AC1Q3PVS
- AR-1G1716
- CTK5D6325
- HMS2762O14
- NSC41323
- AKOS017504307
- DTXSID70285302
- NSC-41323
- CHEMBL1309397
- SMR000393991
- MLS000737035
- 7251-60-7
-
- Inchi： 1S/C7H10ClN3S/c1-2-3-12-6-4-5(8)10-7(9)11-6/h4H,2-3H2,1H3,(H2,9,10,11)
- InChI Key： WNAYBJUQBFQPPT-UHFFFAOYSA-N
- SMILES： ClC1=CC(=NC(N)=N1)SCCC
Computed Properties
- Exact Mass: 203.0286
- Monoisotopic Mass: 203.0283962g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 136
- 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: 2.6
- Topological Polar Surface Area: 77.1?2
Experimental Properties
- PSA: 51.8
- LogP: 2.79550
2-Pyrimidinamine,4-chloro-6-(propylthio)- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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