3-BROMO-5-PROPOXYPHENYLBORONIC ACID

Name: 3-BROMO-5-PROPOXYPHENYLBORONIC ACID
SKU: ACM871126271
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Catalog NumberACM871126271

CAS Number871126-27-1

CategorySalt

IUPAC Name

(3-bromo-5-propoxyphenyl)boronic acid

Molecular Weight

258.91g/mol

Molecular Formula

C9H12BBrO3

Canonical SMILES

B(C1=CC(=CC(=C1)Br)OCCC)(O)O

InChI

InChI=1S/C9H12BBrO3/c1-2-3-14-9-5-7(10(12)13)4-8(11)6-9/h4-6,12-13H,2-3H2,1H3

InChI Key

OHFYAFQVSGUNME-UHFFFAOYSA-N

Purity

97%

Complexity

168

Covalently-Bonded Unit Count

Exact Mass

258.00629g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

258.00629g/mol

Rotatable Bond Count

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