2-(Aminomethyl)pyrazine - CAS 20010-99-5
Catalog: |
BB015443 |
Product Name: |
2-(Aminomethyl)pyrazine |
CAS: |
20010-99-5 |
Synonyms: |
2-pyrazinylmethanamine; pyrazin-2-ylmethanamine |
IUPAC Name: | pyrazin-2-ylmethanamine |
Description: | 2-(Aminomethyl)pyrazine (CAS# 20010-99-5) is a useful synthetic intermediate. It is used to synthesize pyrazolo[4,3-c]pyridinediones as orally bioavailable NADPH oxidase isoform 4 inhibitors for the treatment of idiopathic pulmonary fibrosis. It is also used to prepare pyrazolyl-indoles with the abilities to induce T-cell kinase inhibition. |
Molecular Weight: | 109.13 |
Molecular Formula: | C5H7N3 |
Canonical SMILES: | C1=CN=C(C=N1)CN |
InChI: | InChI=1S/C5H7N3/c6-3-5-4-7-1-2-8-5/h1-2,4H,3,6H2 |
InChI Key: | HQIBSDCOMQYSPF-UHFFFAOYSA-N |
Boiling Point: | 207.5 °C at 760 mmHg |
Density: | 1.138 g/cm3 |
Appearance: | Solid |
LogP: | 0.63560 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113248448-A | 2-arylamine-4-amino quinazoline compound, preparation method and application thereof | 20200213 |
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Complexity: | 64.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 109.063997236 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 109.063997236 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.3 |
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