1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine - CAS 5334-99-6
Catalog: |
BB050167 |
Product Name: |
1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
CAS: |
5334-99-6 |
Synonyms: |
1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine; NSC 1399; 1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 1-methyl-; 4-Amino-1-methylpyrazolo(3,4-d)pyrimidine; 4-Amino-1-methyl-1H-pyrazolo(3,4-d)pyrimidine; 1-methylpyrazolo[5,4-d]pyrimidine-4-ylamine |
IUPAC Name: | 1-methylpyrazolo[3,4-d]pyrimidin-4-amine |
Description: | 1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS# 5334-99-6 ) is a useful research chemical. |
Molecular Weight: | 149.15 |
Molecular Formula: | C6H7N5 |
Canonical SMILES: | CN1C2=C(C=N1)C(=NC=N2)N |
InChI: | InChI=1S/C6H7N5/c1-11-6-4(2-10-11)5(7)8-3-9-6/h2-3H,1H3,(H2,7,8,9) |
InChI Key: | JBMTUXVKTGBMLE-UHFFFAOYSA-N |
Boiling Point: | 354.4±22.0 °C (Predicted) |
Melting Point: | 268-270 °C |
Purity: | 95 % |
Density: | 1.60±0.1 g/cm3 (Predicted) |
GHS Hazard Statement: | H302 (100%): 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 |
Complexity: | 150 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 149.07014524 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.07014524 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 69.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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