Catalog Number |
ACM886593459 |
CAS |
886593-45-9 |
Structure |
|
IUPAC Name |
[4-(2-hydroxypropan-2-yl)phenyl]boronic acid |
Synonyms |
886593-45-9;(4-(2-Hydroxypropan-2-yl)phenyl)boronic acid;4-(2-Hydroxypropan-2-yl)phenylboronic acid;4-(2-Hydroxy-2-propanyl)phenylboronic Acid;[4-(2-Hydroxypropan-2-yl)phenyl]boronic acid;Boronic acid, [4-(1-hydroxy-1-methylethyl)phenyl]-;MFCD09992905;ACMC-209qw8;SCHEMBL722182;AMBA00029;DTXSID10717192;ANW-39126;BBL102726;STL556532;2-(4-phenylboronic acid)propan-2-ol;AKOS006313221;ZINC169747395;CS-W006341;DS-3730;LS11333;QC-4861;AK101674;AM808077;DA-01526;SY025044;FT-0721437;V8689;[4-(2-Hydroxy-2-propanyl)phenyl]boronic acid;4-(1-Hydroxy-1-methylethyl)phenylboronic acid;B-9038;[4-(1-Hydroxy-1-methyl-ethyl)phenyl]boronic acid;Boronic acid,[4-(1-hydroxy-1-methylethyl)phenyl]-;Boronic acid, B-[4-(1-hydroxy-1-methylethyl)phenyl]- |
Molecular Weight |
180.01g/mol |
Molecular Formula |
C9H13BO3 |
Canonical SMILES |
B(C1=CC=C(C=C1)C(C)(C)O)(O)O |
InChI |
InChI=1S/C9H13BO3/c1-9(2,11)7-3-5-8(6-4-7)10(12)13/h3-6,11-13H,1-2H3 |
InChI Key |
DPIDNFWCDMXMDY-UHFFFAOYSA-N |
Complexity |
162 |
Covalently-Bonded Unit Count |
1 |
Exact Mass |
180.0957744g/mol |
Heavy Atom Count |
13 |
Hydrogen Bond Acceptor Count |
3 |
Monoisotopic Mass |
180.0957744g/mol |
Rotatable Bond Count |
2 |
Topological Polar Surface Area |
60.7Ų |