1-(Cyclopropylmethyl)pyrazole-4-boronic acid - CAS 1983202-21-6
Catalog: |
BB068858 |
Product Name: |
1-(Cyclopropylmethyl)pyrazole-4-boronic acid |
CAS: |
1983202-21-6 |
Synonyms: |
1-(Cyclopropylmethyl)pyrazole-4-boronic acid; 1-Cyclopropylmethyl-1H-pyrazole-4-boronic acid; [1-(cyclopropylmethyl)pyrazol-4-yl]boronic acid; 1-(Cyclopropylmethyl)-1H-pyrazole-4-boronic Acid; (1-(Cyclopropylmethyl)-1H-pyrazol-4-yl)boronic acid; [1-(cyclopropylmethyl)-1H-pyrazol-4-yl]boronic acid |
IUPAC Name: | [1-(cyclopropylmethyl)pyrazol-4-yl]boronic acid |
Description: | 1-(Cyclopropylmethyl)pyrazole-4-boronic acid |
Molecular Weight: | 165.99 |
Molecular Formula: | C7H11BN2O2 |
Canonical SMILES: | B(C1=CN(N=C1)CC2CC2)(O)O |
InChI: | InChI=1S/C7H11BN2O2/c11-8(12)7-3-9-10(5-7)4-6-1-2-6/h3,5-6,11-12H,1-2,4H2 |
InChI Key: | ZLPPXAMWTWGISQ-UHFFFAOYSA-N |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.0913578 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.0913578 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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