| CAS Number | 1256355-07-3 |
| Catalog Number | AG000O2N(AGN-PC-09PZ24) |
| Chemical Name | 2-Butoxy-4-Chlorophenylboronic Acid |
| IUPAC Name | (2-butoxy-4-chlorophenyl)boronic acid |
| InChI | InChI=1S/C10H14BClO3/c1-2-3-6-15-10-7-8(12)4-5-9(10)11(13)14/h4-5,7,13-14H,2-3,6H2,1H3 |
| InChI Key | YYWQEIZDBBRJAQ-UHFFFAOYSA-N |
| MDL Number | MFCD17015773 |
| Molecular Formula | C10H14BClO3 |
| Molecular Weight | 228.4804 |
| SMILES | CCCCOC1=C(C=CC(Cl)=C1)B(O)O |
| Synonyms | 1256355-07-3,
(2-Butoxy-4-chlorophenyl)boronic acid,
2-BUTOXY-4-CHLOROPHENYLBORONIC ACID,
ACMC-209ay2,
CTK4B4581,
DTXSID80681710,
ANW-18456,
MFCD17015773,
AKOS015839682,
ZINC169934558,
FS-5781,
OR360537,
AX8236173,
TR-035239,
X1903,
Boronic acid, B-(2-butoxy-4-chlorophenyl)-,
B-2754,
I04-2244,
C10H14BClO3,
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| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.479g/mol |
| Monoisotopic Mass | 228.072g/mol |
| Rotatable Bond Count | 5 |
| 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