| CAS Number | 936940-92-0 |
| Catalog Number | AG003NEZ(AGN-PC-0WAC87) |
| Chemical Name | 7-Chloroquinoline-4-boronic acid |
| IUPAC Name | (7-chloroquinolin-4-yl)boronic acid |
| InChI | InChI=1S/C9H7BClNO2/c11-6-1-2-7-8(10(13)14)3-4-12-9(7)5-6/h1-5,13-14H |
| InChI Key | UUNBQBDIZNZHAC-UHFFFAOYSA-N |
| MDL Number | MFCD12546510 |
| Molecular Formula | C9H7BClNO2 |
| Molecular Weight | 207.4214 |
| SMILES | OB(C1=C2C(C=C(C=C2)Cl)=NC=C1)O |
| Synonyms | 7-CHLOROQUINOLINE-4-BORONIC ACID,
936940-92-0,
7-chloroquinolin-4-ylboronic acid,
(7-chloroquinolin-4-yl)boronic acid,
PubChem24082,
ACMC-209rn1,
CTK5H2837,
DTXSID90675185,
ANW-40091,
MFCD12546510,
AKOS015851201,
ZINC169904871,
FCH1367236,
OR360997,
TR-038474,
V9303,
B-4981,
I04-2583,
C9H7BClNO2,
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.42g/mol |
| Monoisotopic Mass | 207.026g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number