2-(1-Methyl-1H-pyrazol-5-yl)ethanamine - CAS 807315-40-8
Catalog: |
BB052025 |
Product Name: |
2-(1-Methyl-1H-pyrazol-5-yl)ethanamine |
CAS: |
807315-40-8 |
Synonyms: |
2-(1-methyl-1H-pyrazol-5-yl)ethan-1-amine |
IUPAC Name: | 2-(2-methylpyrazol-3-yl)ethanamine |
Molecular Weight: | 125.17 |
Molecular Formula: | C6H11N3 |
Canonical SMILES: | CN1C(=CC=N1)CCN |
InChI: | InChI=1S/C6H11N3/c1-9-6(2-4-7)3-5-8-9/h3,5H,2,4,7H2,1H3 |
InChI Key: | UGBXFYZRZQPHFK-UHFFFAOYSA-N |
Boiling Point: | 233.6±15.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 1.11±0.1 g/cm3 |
Appearance: | Colorless to Pale Yellow Liquid |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Complexity: | 84.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 125.095297364 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 125.095297364 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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