trans-1-Propenylboronic acid MIDA ester

Name: trans-1-Propenylboronic acid MIDA ester
SKU: ACM1104637468
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Catalog NumberACM1104637468

CAS Number1104637-46-8

CategorySalt

IUPAC Name

6-methyl-2-[(E)-prop-1-enyl]-1,3,6,2-dioxazaborocane-4,8-dione

Molecular Weight

197g/mol

Molecular Formula

C8H12BNO4

Canonical SMILES

B1(OC(=O)CN(CC(=O)O1)C)C=CC

InChI

InChI=1S/C8H12BNO4/c1-3-4-9-13-7(11)5-10(2)6-8(12)14-9/h3-4H,5-6H2,1-2H3/b4-3+

InChI Key

PKQGENZEEBZVIL-ONEGZZNKSA-N

Complexity

246

Covalently-Bonded Unit Count

Exact Mass

197.085938g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

197.085938g/mol

Rotatable Bond Count

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