5-Bromo-2,2'-bithiophene-5-boronic acid MIDA ester

Name: 5-Bromo-2,2'-bithiophene-5-boronic acid MIDA ester
SKU: ACM1104636794
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Catalog NumberACM1104636794

CAS Number1104636-79-4

CategorySalt

IUPAC Name

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

Molecular Weight

400.1g/mol

Molecular Formula

C13H11BBrNO4S2

Canonical SMILES

B1(OC(=O)CN(CC(=O)O1)C)C2=CC=C(S2)C3=CC=C(S3)Br

InChI

InChI=1S/C13H11BBrNO4S2/c1-16-6-12(17)19-14(20-13(18)7-16)10-4-2-8(21-10)9-3-5-11(15)22-9/h2-5H,6-7H2,1H3

InChI Key

FNDOSCIRFUFXGS-UHFFFAOYSA-N

Complexity

438

Covalently-Bonded Unit Count

Exact Mass

398.94059g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

398.94059g/mol

Rotatable Bond Count

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