5-Bromo-2-thiophenylboronic acid MIDA ester

Name: 5-Bromo-2-thiophenylboronic acid MIDA ester
SKU: ACM943552316
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Catalog NumberACM943552316

CAS Number943552-31-6

CategorySalt

IUPAC Name

2-(5-bromothiophen-2-yl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Molecular Weight

317.96g/mol

Molecular Formula

C9H9BBrNO4S

Canonical SMILES

B1(OC(=O)CN(CC(=O)O1)C)C2=CC=C(S2)Br

InChI

InChI=1S/C9H9BBrNO4S/c1-12-4-8(13)15-10(16-9(14)5-12)6-2-3-7(11)17-6/h2-3H,4-5H2,1H3

InChI Key

IHKDTCFWTZPRTA-UHFFFAOYSA-N

Complexity

312

Covalently-Bonded Unit Count

Exact Mass

316.95287g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

316.95287g/mol

Rotatable Bond Count

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