| CAS Number | 86253-12-5 |
| Catalog Number | AG00IDZ7(AGN-PC-0LNLA7) |
| Chemical Name | Tert-butylboronic acid |
| IUPAC Name | tert-butylboronic acid |
| InChI | InChI=1S/C4H11BO2/c1-4(2,3)5(6)7/h6-7H,1-3H3 |
| InChI Key | FTPPXKVBGUSCNZ-UHFFFAOYSA-N |
| MDL Number | MFCD02078974 |
| Molecular Formula | C4H11BO2 |
| Molecular Weight | 101.9399 |
| SMILES | CC(B(O)O)(C)C |
| Synonyms | Tert-butylboronic Acid,
86253-12-5,
tert-butylboranediol,
t-butylboronic acid,
AC1NPDR2,
SCHEMBL1453178,
Boronic acid, (1,1-dimethylethyl)-,
AKOS001036121,
ZINC169842349,
MCULE-9781009287,
NE35038,
RP18758,
EN001009,
ACN-054011,
CID5156670,
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| Complexity | 55.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 102.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 101.94g/mol |
| Monoisotopic Mass | 102.085g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^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