3-Bromopyrazolo[1,5-a]pyrimidine-2-carbonyl chloride - CAS 861224-59-1
Catalog: |
BB045642 |
Product Name: |
3-Bromopyrazolo[1,5-a]pyrimidine-2-carbonyl chloride |
CAS: |
861224-59-1 |
Synonyms: |
3-bromo-8-hydropyrazolo[1,5-a]pyrimidine-2-carbonyl chloride |
IUPAC Name: | 3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl chloride |
Description: | 3-Bromopyrazolo[1,5-a]pyrimidine-2-carbonyl chloride (CAS# 861224-59-1 ) is a useful research chemical. |
Molecular Weight: | 260.47 |
Molecular Formula: | C7H3BrClN3O |
Canonical SMILES: | C1=CN2C(=C(C(=N2)C(=O)Cl)Br)N=C1 |
InChI: | InChI=1S/C7H3BrClN3O/c8-4-5(6(9)13)11-12-3-1-2-10-7(4)12/h1-3H |
InChI Key: | WALXWKCBTRILKD-UHFFFAOYSA-N |
Density: | 2.0±0.1 g/cm3 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.9148 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.9148 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 47.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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