[2-(azetidin-1-yl)pyrimidin-5-yl]boronic Acid - CAS 1411643-59-8
Catalog: |
BB055148 |
Product Name: |
[2-(azetidin-1-yl)pyrimidin-5-yl]boronic Acid |
CAS: |
1411643-59-8 |
Synonyms: |
(2-(Azetidin-1-yl)pyrimidin-5-yl)boronic acid; [2-(azetidin-1-yl)pyrimidin-5-yl]boronic acid; 2-(azetidin-1-yl)pyrimidin-5-ylboronic acid |
IUPAC Name: | [2-(azetidin-1-yl)pyrimidin-5-yl]boronic acid |
Description: | [2-(azetidin-1-yl)pyrimidin-5-yl]boronic acid is a useful research chemical |
Molecular Weight: | 178.98 |
Molecular Formula: | C7H10BN3O2 |
Canonical SMILES: | B(C1=CN=C(N=C1)N2CCC2)(O)O |
InChI: | InChI=1S/C7H10BN3O2/c12-8(13)6-4-9-7(10-5-6)11-2-1-3-11/h4-5,12-13H,1-3H2 |
InChI Key: | NQBHKXVNPWRYKQ-UHFFFAOYSA-N |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.0866067 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.0866067 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 69.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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