[2-Amino-5-(trifluoromethyl)phenyl]boronic acid - CAS 1793091-29-8
Catalog: |
BB074431 |
Product Name: |
[2-Amino-5-(trifluoromethyl)phenyl]boronic acid |
CAS: |
1793091-29-8 |
Synonyms: |
(2-Amino-5-(trifluoromethyl)phenyl)boronic acid; [2-AMINO-5-(TRIFLUOROMETHYL)PHENYL]BORONIC ACID; [2-Amino-5-(trifluoromethyl)phenyl]boronicacid; (2-Amino-5-(trifluoromethyl)phenyl)boronicacid |
IUPAC Name: | [2-amino-5-(trifluoromethyl)phenyl]boronic acid |
Description: | [2-Amino-5-(trifluoromethyl)phenyl]boronic acid |
Molecular Weight: | 204.94 |
Molecular Formula: | C7H7BF3NO2 |
Canonical SMILES: | B(C1=C(C=CC(=C1)C(F)(F)F)N)(O)O |
InChI: | InChI=1S/C7H7BF3NO2/c9-7(10,11)4-1-2-6(12)5(3-4)8(13)14/h1-3,13-14H,12H2 |
InChI Key: | GBIGUIVUUCIHGT-UHFFFAOYSA-N |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.0521931 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.0521931 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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