3-(4'-Heptyloxyphenoxymethyl)phenylboronic acid

Name: 3-(4'-Heptyloxyphenoxymethyl)phenylboronic acid
SKU: ACM870778931-1
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Catalog NumberACM870778931-1

CAS Number870778-93-1

CategorySalt

IUPAC Name

[3-[(4-heptoxyphenoxy)methyl]phenyl]boronic acid

Molecular Weight

342.2g/mol

Molecular Formula

C20H27BO4

Canonical SMILES

B(C1=CC(=CC=C1)COC2=CC=C(C=C2)OCCCCCCC)(O)O

InChI

InChI=1S/C20H27BO4/c1-2-3-4-5-6-14-24-19-10-12-20(13-11-19)25-16-17-8-7-9-18(15-17)21(22)23/h7-13,15,22-23H,2-6,14,16H2,1H3

InChI Key

YUUHHALRCQFRSL-UHFFFAOYSA-N

Complexity

332

Covalently-Bonded Unit Count

Exact Mass

342.20024g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

342.20024g/mol

Rotatable Bond Count

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