Cas no 91691-91-7 (2,6-bis(1-methylpropoxy)pyrimidin-4-amine)
91691-91-7 structure
Product Name:2,6-bis(1-methylpropoxy)pyrimidin-4-amine
CAS No:91691-91-7
MF:C12H21N3O2
MW:239.314042806625
CID:1968930
PubChem ID:478123
Update Time:2025-04-21
2,6-bis(1-methylpropoxy)pyrimidin-4-amine Chemical and Physical Properties
Names and Identifiers
-
- 2,6-bis(1-methylpropoxy)pyrimidin-4-amine
- 2,6-di(butan-2-yloxy)pyrimidin-4-amine
- 2,6-Di-(sec-butoxy)-4-aminopyrimidine
- Pyrimidine, 4-amino-2,6-di-sec-butoxy-
- DTXSID40919586
- 2,6-Bis[(butan-2-yl)oxy]pyrimidin-4-amine
- 4-Pyrimidinamine, 2,6-bis(1-methylpropoxy)-
- 2,6-disec-butoxypyrimidin-4-amine
- 91691-91-7
-
- Inchi： 1S/C12H21N3O2/c1-5-8(3)16-11-7-10(13)14-12(15-11)17-9(4)6-2/h7-9H,5-6H2,1-4H3,(H2,13,14,15)
- InChI Key： PYJCXRJFSJTQMZ-UHFFFAOYSA-N
- SMILES： O(C1C=C(N)N=C(N=1)OC(C)CC)C(C)CC
Computed Properties
- Exact Mass: 239.163377
- Monoisotopic Mass: 239.163377
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 216
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 70.3
- XLogP3: 3.1
Experimental Properties
- Density: 1.059
- Boiling Point: 380.8°C at 760 mmHg
- Flash Point: 184.1°C
- Refractive Index: 1.511
2,6-bis(1-methylpropoxy)pyrimidin-4-amine Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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