4,6-Dichloro-2,5-dimethylpyrimidine - CAS 1780-33-2
Catalog: |
BB013382 |
Product Name: |
4,6-Dichloro-2,5-dimethylpyrimidine |
CAS: |
1780-33-2 |
Synonyms: |
4,6-dichloro-2,5-dimethylpyrimidine; 4,6-dichloro-2,5-dimethylpyrimidine |
IUPAC Name: | 4,6-dichloro-2,5-dimethylpyrimidine |
Description: | 4,6-Dichloro-2,5-dimethylpyrimidine (CAS# 1780-33-2) is a useful research chemical. |
Molecular Weight: | 177.03 |
Molecular Formula: | C6H6Cl2N2 |
Canonical SMILES: | CC1=C(N=C(N=C1Cl)C)Cl |
InChI: | InChI=1S/C6H6Cl2N2/c1-3-5(7)9-4(2)10-6(3)8/h1-2H3 |
InChI Key: | BXVKGWQEEXPBAW-UHFFFAOYSA-N |
Boiling Point: | 232.3 °C at 760 mmHg |
Density: | 1.337 g/cm3 |
LogP: | 2.40020 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021002986-A2 | Bax inhibitors and uses thereof | 20190531 |
US-2019308950-A1 | Substituted pyridine and pyrimidines and their use as glun2b receptor modulators | 20180404 |
WO-2019193516-A2 | Substituted pyridine and pyrimidines and their use as glun2b receptor modulators | 20180404 |
EP-3774732-A2 | Substituted pyridine and pyrimidines and their use as glun2b receptor modulators | 20180404 |
JP-2021520381-A | Substituted pyridines and pyrimidines and their use as GLUN2B receptor regulators | 20180404 |
Complexity: | 108 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.9908036 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.9908036 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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