1-Methyl-4-(tributylstannyl)-1H-pyrazole
Product Information
Molecular Formula
C16H32N2Sn
Molecular Weight
371.15
Description
1-Methyl-4-(tributylstannyl)-1H-pyrazole (CAS# 179055-21-1 ) is a useful research chemical.
Synonyms
tributyl-(1-methylpyrazol-4-yl)stannane
IUPAC Name
tributyl-(1-methylpyrazol-4-yl)stannane
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
Refractive Index
n20/D 1.563
LogP
4.06080
Safety Information
Hazards
H301-H312-H315-H319-H372-H410
Precautionary Statement
P273-P280-P301 + P310-P305 + P351 + P338-P314-P501
Signal Word
Danger
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
10
Exact Mass
372.158752 g/mol
Monoisotopic Mass
372.158752 g/mol
Topological Polar Surface Area
17.8Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
211
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2020239951-A1 | Amino quinazoline derivatives as p2x3 inhibitors | 2019-05-31 |
| AU-2020281923-A1 | Amino quinazoline derivatives as P2X3 inhibitors | 2019-05-31 |
| KR-20220016498-A | Aminoquinazoline derivatives as P2X3 inhibitors | 2019-05-31 |
| AU-2014295538-A1 | Substituted quinazolin-4-one derivatives | 2013-07-24 |
| AU-2014295538-B2 | Substituted quinazolin-4-one derivatives | 2013-07-24 |
| EA-031430-B1 | SUBSTITUTED HINAZOLIN-4-SHE DERIVATIVES | 2013-07-24 |
| EP-3024827-A1 | Substituted quinazolin-4-one derivatives | 2013-07-24 |
| EP-3024827-B1 | Substituted quinazolin-4-one derivatives | 2013-07-24 |
| TW-201534598-A | Substituted quinazolin-4-one derivative | 2013-07-24 |
| US-2016168131-A1 | Substituted Quinazolin-4-one Derivatives | 2013-07-24 |
