138500-86-4
Product Name:
4-(Cyanomethyl)benzeneboronic acid pinacol ester
Formula:
C14H18BNO2
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SAFETY INFORMATION
Signal word | Warning |
---|---|
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral |
COMPUTED DESCRIPTORS
Molecular Weight | 243.11 g/mol |
---|---|
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 243.1430590 g/mol |
Monoisotopic Mass | 243.1430590 g/mol |
Topological Polar Surface Area | 42.2 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 334 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |