3-(2-Pyridyl)propylamine - CAS 15583-16-1
Catalog: |
BB011166 |
Product Name: |
3-(2-Pyridyl)propylamine |
CAS: |
15583-16-1 |
Synonyms: |
3-(2-pyridinyl)-1-propanamine; 3-pyridin-2-ylpropan-1-amine |
IUPAC Name: | 3-pyridin-2-ylpropan-1-amine |
Description: | 3-(2-Pyridyl)propylamine (CAS# 15583-16-1) is used in the preparation of 2,4,6-s-triazine derivatives with biological and anti-malarial properties. |
Molecular Weight: | 136.19 |
Molecular Formula: | C8H12N2 |
Canonical SMILES: | C1=CC=NC(=C1)CCCN |
InChI: | InChI=1S/C8H12N2/c9-6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,3,5-6,9H2 |
InChI Key: | UGYRJDSEKCYZKI-UHFFFAOYSA-N |
Boiling Point: | 227.5 ℃ at 760 mmHg |
Density: | 1.003 g/cm3 |
Appearance: | Colorless liquid |
LogP: | 1.67320 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021014365-A1 | Macrocyclic compounds as sting agonists and methods and uses thereof | 20190722 |
WO-2019238786-A1 | Modulators of stimulator of interferon genes (sting) | 20180612 |
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EP-3475268-A1 | Compounds for treating disorders sensitive to serotoninergic regulation controlled by the 5-ht1a receptors | 20160624 |
Complexity: | 83.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.100048391 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.100048391 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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Pyridines
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