2-Amino-4-(trifluoromethyl)pyrimidine - CAS 16075-42-6
Catalog: |
BB011664 |
Product Name: |
2-Amino-4-(trifluoromethyl)pyrimidine |
CAS: |
16075-42-6 |
Synonyms: |
4-(trifluoromethyl)pyrimidin-2-amine |
IUPAC Name: | 4-(trifluoromethyl)pyrimidin-2-amine |
Description: | 2-Amino-4-(trifluoromethyl)pyrimidine (CAS# 16075-42-6) is a useful research chemical. |
Molecular Weight: | 163.10 |
Molecular Formula: | C5H4F3N3 |
Canonical SMILES: | C1=CN=C(N=C1C(F)(F)F)N |
InChI: | InChI=1S/C5H4F3N3/c6-5(7,8)3-1-2-10-4(9)11-3/h1-2H,(H2,9,10,11) |
InChI Key: | NKOTXYPTXKUCDL-UHFFFAOYSA-N |
Boiling Point: | 260.7 °C at 760 mmHg |
Melting Point: | 175-177 °C |
Purity: | 95 % |
Density: | 1.46 g/cm3 |
MDL: | MFCD00828624 |
LogP: | 1.65880 |
GHS Hazard Statement: | H300 (97.01%): Fatal if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P285, P301+P310, P304+P340, P304+P341, P305+P351+P338, P312, P321, P330, P337+P313, P342+P311, P391, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2016060256-A1 | Thiazole-substituted aminopyrimidines as spleen tyrosine kinase inhibitors | 20130426 |
WO-2014176216-A1 | Thiazole-substituted aminopyrimidines as spleen tyrosine kinase inhibitors | 20130426 |
WO-2014140076-A1 | 2,3-disubstituted 1 -acyl-4-amino-1,2,3,4-tetrahydroquinoline derivatives and their use as bromodomain inhibitors | 20130314 |
EP-2922848-A1 | Oxazolidin-2-one-pyrimidine derivatives | 20121112 |
US-2014135330-A1 | Oxazolidin-2-one-Pyrimidine Derivatives | 20121112 |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.03573163 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.03573163 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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Amines and Anilines
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