[2-(But-3-en-1-yl)phenyl]boronic Acid - CAS 1334402-81-1
Catalog: |
BB070775 |
Product Name: |
[2-(But-3-en-1-yl)phenyl]boronic Acid |
CAS: |
1334402-81-1 |
Synonyms: |
(2-(But-3-en-1-yl)phenyl)boronic acid; (2-but-3-enylphenyl)boronic acid; [2-(But-3-en-1-yl)phenyl]boronic acid; (2-(But-3-en-1-yl)phenyl)boronicacid |
IUPAC Name: | (2-but-3-enylphenyl)boronic acid |
Description: | [2-(But-3-en-1-yl)phenyl]boronic Acid is an arylboronic acid used for radical cyclizations and the preparation of alkylene-bridged inhibitors of human immunodeficiency virus replication. |
Molecular Weight: | 176.02 |
Molecular Formula: | C10H13BO2 |
Canonical SMILES: | B(C1=CC=CC=C1CCC=C)(O)O |
InChI: | InChI=1S/C10H13BO2/c1-2-3-6-9-7-4-5-8-10(9)11(12)13/h2,4-5,7-8,12-13H,1,3,6H2 |
InChI Key: | DVVHNJPNOJSHDI-UHFFFAOYSA-N |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.1008598 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.1008598 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 40.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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