Cas no 52382-35-1 (5-phenoxypyrimidin-4-amine)
5-phenoxypyrimidin-4-amine structure
Product Name:5-phenoxypyrimidin-4-amine
CAS No:52382-35-1
MF:C10H10ClN3O
MW:223.658900737762
CID:936800
PubChem ID:21557074
Update Time:2025-04-19
5-phenoxypyrimidin-4-amine Chemical and Physical Properties
Names and Identifiers
-
- 5-phenoxypyrimidin-4-amine
- 5-phenoxypyrimidin-4-amine,hydrochloride
- SCHEMBL11790082
- 4-amino-5-phenoxy pyrimidine hydrochloride
- NSC 301162
- NSC301162
- 52382-35-1
- 5-Phenoxypyrimidin-4-amine--hydrogen chloride (1/1)
- DTXSID90615844
- NSC-301162
- GFFCOFCTSAQESZ-UHFFFAOYSA-N
- DS-005761
-
- Inchi： 1S/C10H9N3O.ClH/c11-10-9(6-12-7-13-10)14-8-4-2-1-3-5-8;/h1-7H,(H2,11,12,13);1H
- InChI Key： GFFCOFCTSAQESZ-UHFFFAOYSA-N
- SMILES： Cl.O(C1=CN=CN=C1N)C1C=CC=CC=1
Computed Properties
- Exact Mass: 187.07467
- Monoisotopic Mass: 223.0512396g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 171
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 61?2
Experimental Properties
- PSA: 61.03
5-phenoxypyrimidin-4-amine Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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