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| CAS No.: | 696-83-3 |
|---|---|
| Name: | 2,4-DIAMINO-6-FLUOROPYRIMIDINE |
| Molecular Structure: | |
|
|
|
| Formula: | C4H5 F N4 |
| Molecular Weight: | 128.109 |
| Synonyms: | Pyrimidine,2,4-diamino-6-fluoro- (7CI,8CI); NSC 527000 |
| EINECS: | 604-604-1 |
| Density: | 1.513 g/cm3 |
| Boiling Point: | 408.1 °C at 760 mmHg |
| Flash Point: | 200.6 °C |
| Risk Codes: | 36 |
| Safety: | 26 |
| PSA: | 77.82000 |
| LogP: | 0.94250 |
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- 696-82-2
2,4,6-trifluoropyrimidine
A
- 675-12-7
4-amino-2,6-difluoropyrimidine
B
- 675-11-6
2-amino-4,6-difluoropyrimidine
C
- 696-83-3
2,4-diamino-6-fluoropyrimidine
| Conditions | Yield |
|---|---|
| With ammonia In methanol at 20℃; | A n/a B n/a C 67% |
| Conditions | Yield |
|---|---|
| With ammonium hydroxide In acetonitrile at 0 - 40℃; |
| Conditions | Yield |
|---|---|
| With sodium hydroxide In methanol; water at 20℃; Rate constant; |
- 696-83-3
2,4-diamino-6-fluoropyrimidine
- 1353054-66-6
2,4-diamino-5-chloro-6-fluoropyrimidine
| Conditions | Yield |
|---|---|
| With N-chloro-succinimide In methanol; ethanol at 50℃; Cooling with ice; |
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Chemistry
Molecular structure of 2,4-Diamino-6-fluoropyrimidine (CAS NO.696-83-3) is:
Product Name: 2,4-Diamino-6-fluoropyrimidine
CAS Registry Number: 696-83-3
IUPAC Name: 6-Fluoropyrimidine-2,4-diamine
Molecular Weight: 128.107703 [g/mol]
Molecular Formula: C4H5FN4
XLogP3-AA: -0.1
H-Bond Donor: 2
H-Bond Acceptor: 5
Index of Refraction: 1.65
Molar Refractivity: 30.9 cm3
Molar Volume: 84.6 cm3
Surface Tension: 81.5 dyne/cm
Density: 1.513 g/cm3
Flash Point: 200.6 °C
Enthalpy of Vaporization: 66 kJ/mol
Boiling Point: 408.1 °C at 760 mmHg
Vapour Pressure: 7.2E-07 mmHg at 25 °C
Product Categories: PYRIMIDINE;APIs & Intermediate
Canonical SMILES: C1=C(N=C(N=C1F)N)N
InChI: InChI=1S/C4H5FN4/c5-2-1-3(6)9-4(7)8-2/h1H,(H4,6,7,8,9)
InChIKey: BOVQRQCKNKKBOR-UHFFFAOYSA-N
Specification
2,4-Diamino-6-fluoropyrimidine , its cas register number is 696-83-3. It also can be called 2,4-Pyrimidinediamine,6-fluoro- .