Cas no 874494-82-3 (2,4-Pyrimidinediamine,5-ethoxy-)
874494-82-3 structure
Product Name:2,4-Pyrimidinediamine,5-ethoxy-
CAS No:874494-82-3
MF:C6H10N4O
MW:154.169800281525
CID:709698
PubChem ID:76851468
Update Time:2025-04-19
2,4-Pyrimidinediamine,5-ethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pyrimidinediamine,5-ethoxy-
- Pyrimidine, 2,4-diamino-5-ethoxy- (5CI)
- 874494-82-3
- 5-Ethoxypyrimidine-2,4-diamine
-
- Inchi: 1S/C6H10N4O/c1-2-11-4-3-9-6(8)10-5(4)7/h3H,2H2,1H3,(H4,7,8,9,10)
- InChI Key: BQKLLDSOMOBSDF-UHFFFAOYSA-N
- SMILES: O(CC)C1=CN=C(N)N=C1N
Computed Properties
- Exact Mass: 154.085
- Monoisotopic Mass: 154.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 121
- 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
- Topological Polar Surface Area: 87A^2
- XLogP3: -0.2
2,4-Pyrimidinediamine,5-ethoxy- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
874494-82-3 (2,4-Pyrimidinediamine,5-ethoxy-) Related Products
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