2,6-Dichloro-7-methylpurine - CAS 2273-93-0
Catalog: |
BB017733 |
Product Name: |
2,6-Dichloro-7-methylpurine |
CAS: |
2273-93-0 |
Synonyms: |
2,6-Dichloro-7-methyl-7H-purine; 2,6-Dichlor-7-methyl-ourin; 7-Methyl-2 6-dichlor-purin; Purine,2,6-dichloro-7-methyl |
IUPAC Name: | 2,6-dichloro-7-methylpurine |
Description: | 2,6-Dichloro-7-methylpurine (CAS# 2273-93-0) is used in the preparation and discover of novel mTOR INHIBITORS. |
Molecular Weight: | 203.03 |
Molecular Formula: | C6H4Cl2N4 |
Canonical SMILES: | CN1C=NC2=C1C(=NC(=N2)Cl)Cl |
InChI: | InChI=1S/C6H4Cl2N4/c1-12-2-9-5-3(12)4(7)10-6(8)11-5/h2H,1H3 |
InChI Key: | HVMUWHZAZGTMJK-UHFFFAOYSA-N |
Boiling Point: | 307.2±52.0 °C |
Melting Point: | 195.5-196 °C |
Purity: | ≥ 95 % |
Density: | 1.76±0.10 g/cm3 |
Appearance: | Gray crystalline powder |
MDL: | MFCD00039690 |
LogP: | 1.67010 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.9813015 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.9813015 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 43.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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