CAS 338998-93-9|4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane|4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane|2-(5-Methylfur-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaboro...

General Information

Structure

Molecular Formula

C₁₁H₁₇BO₃

Molecular Mass

208.06188

Exact Mass

208.1270748

Charge

InChI

InChI=1S/C11H17BO3/c1-8-6-7-9(13-8)12-14-10(2,3)11(4,5)15-12/h6-7H,1-5H3

InChIKey

FNPZFZKLYGWKLH-UHFFFAOYSA-N

Canonic Smiles

Cc1ccc(o1)B1OC(C(O1)(C)C)(C)C

Isomeric Smiles

o1c(ccc1B1OC(C(O1)(C)C)(C)C)C

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

3.0418

LogD (pH = 7.4)

3.0418

Log P

3.0418

Molar Refractivity

52.6295

Polarizability

22.636803

Polar Surface Area

31.6

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC Traditional name

4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane

IUPAC name

4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane

Synonyms

5-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxoborolan-2-yl)furan2-(5-Methylfur-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane5-Methylfuran-2-boronic acid, pinacol ester 95%5-Methyl-2-furanboronic acid pinacol ester4,4,5,5-Tetramethyl-2-(5-methyl-furan-2-yl)-(1,3,2)dioxaborolane2-甲基呋喃-5-硼酸频哪醇酯4,4,5,5-四甲基-2-(5-甲基-呋喃-2-基)-(1,3,2)二氧杂戊硼烷5-METHYLFURAN-2-BORONIC ACID PINACOL ESTER5-甲基呋喃-2-硼酸频哪醇酯5-Methylfuran-2-boronic acid pinacol ester

Names and Identifiers

Registration numbers

CAS Number

MDL Number

PubChem SID

PubChem CID

Registration numbers

Properties