1-Methyl-4-(tributylstannyl)-1H-pyrazole - CAS 179055-21-1
Catalog: |
BB013534 |
Product Name: |
1-Methyl-4-(tributylstannyl)-1H-pyrazole |
CAS: |
179055-21-1 |
Synonyms: |
tributyl-(1-methylpyrazol-4-yl)stannane |
IUPAC Name: | tributyl-(1-methylpyrazol-4-yl)stannane |
Description: | 1-Methyl-4-(tributylstannyl)-1H-pyrazole (CAS# 179055-21-1 ) is a useful research chemical. |
Molecular Weight: | 371.15 |
Molecular Formula: | C16H32N2Sn |
Canonical SMILES: | CCCC[Sn](CCCC)(CCCC)C1=CN(N=C1)C |
InChI: | InChI=1S/C4H5N2.3C4H9.Sn/c1-6-4-2-3-5-6;3*1-3-4-2;/h3-4H,1H3;3*1,3-4H2,2H3; |
InChI Key: | LNECVNPGDBLIEM-UHFFFAOYSA-N |
Boiling Point: | 126-128 °C |
Flash Point: | 300.2 °F |
Purity: | 97 % |
Density: | 1.135 g/mL at 25 °C |
Appearance: | Colorless to orange liquid |
LogP: | 4.06080 |
Refractive Index: | n20/D 1.563 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H372 (100%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]; H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]; H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P273-P280-P301 + P310-P305 + P351 + P338-P314-P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020239951-A1 | Amino quinazoline derivatives as p2x3 inhibitors | 20190531 |
AU-2014295538-A1 | Substituted quinazolin-4-one derivatives | 20130724 |
AU-2014295538-B2 | Substituted quinazolin-4-one derivatives | 20130724 |
EA-031430-B1 | SUBSTITUTED HINAZOLIN-4-SHE DERIVATIVES | 20130724 |
EP-3024827-A1 | Substituted quinazolin-4-one derivatives | 20130724 |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 372.158752 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 372.158752 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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