4-(Dimethylcarbamoyl)-2-methylphenylboronic Acid - CAS 159306-35-1
Catalog: |
BB011519 |
Product Name: |
4-(Dimethylcarbamoyl)-2-methylphenylboronic Acid |
CAS: |
159306-35-1 |
Synonyms: |
[4-[dimethylamino(oxo)methyl]-2-methylphenyl]boronic acid; [4-(dimethylcarbamoyl)-2-methylphenyl]boronic acid |
IUPAC Name: | [4-(dimethylcarbamoyl)-2-methylphenyl]boronic acid |
Description: | 4-(Dimethylcarbamoyl)-2-methylphenylboronic Acid (CAS# 159306-35-1 ) is a useful research chemical. |
Molecular Weight: | 207.03 |
Molecular Formula: | C10H14NO3B |
Canonical SMILES: | B(C1=C(C=C(C=C1)C(=O)N(C)C)C)(O)O |
InChI: | InChI=1S/C10H14BNO3/c1-7-6-8(10(13)12(2)3)4-5-9(7)11(14)15/h4-6,14-15H,1-3H3 |
InChI Key: | WJHRWLGLPHMHMC-UHFFFAOYSA-N |
Complexity: | 233 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.1066735 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.1066735 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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