| CAS Number | 1313760-77-8 |
| Catalog Number | AG000W1M(AGN-PC-06GMI1) |
| Chemical Name | (2-(Cyclohexyloxy)phenyl)boronic acid |
| IUPAC Name | (2-cyclohexyloxyphenyl)boronic acid |
| InChI | InChI=1S/C12H17BO3/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h4-5,8-10,14-15H,1-3,6-7H2 |
| InChI Key | ASBLZMXOCYWQBZ-UHFFFAOYSA-N |
| MDL Number | MFCD11103726 |
| Molecular Formula | C12H17BO3 |
| Molecular Weight | 220.0726 |
| SMILES | C1(CCCCC1)OC1=C(C=CC=C1)B(O)O |
| Synonyms | (2-(Cyclohexyloxy)phenyl)boronic acid,
1313760-77-8,
2-(Cyclohexyloxy)phenylboronic acid,
[2-(Cyclohexyloxy)phenyl]boronic acid,
ACMC-20aiw0,
DTXSID50655549,
[2-(cyclohexyloxy)phenyl]boranediol,
ANW-75406,
MFCD11103726,
AKOS009319993,
ZINC169746646,
TC-164151,
Boronic acid, B-[2-(cyclohexyloxy)phenyl]-,
ST24020160,
Z9566,
B-7090,
I04-2356,
C12H17BO3,
(2-(Cyclohexyloxy)phenyl)boronicacid,
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| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.075g/mol |
| Monoisotopic Mass | 220.127g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.7A^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