trans-2-Bromovinylboronic acid MIDA ester

Name: trans-2-Bromovinylboronic acid MIDA ester
SKU: ACM1104636681
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Catalog NumberACM1104636681

CAS Number1104636-68-1

CategorySalt

IUPAC Name

1-[(E)-2-bromoethenyl]-5-methyl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione

Molecular Weight

261.87g/mol

Molecular Formula

C7H9BBrNO4

Canonical SMILES

[B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C=CBr

InChI

InChI=1S/C7H9BBrNO4/c1-10-4-6(11)13-8(10,2-3-9)14-7(12)5-10/h2-3H,4-5H2,1H3/b3-2+

InChI Key

AYYUZOQBVAPABR-NSCUHMNNSA-N

Complexity

323

Covalently-Bonded Unit Count

Exact Mass

260.9808g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

260.9808g/mol

Rotatable Bond Count

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