| CAS Number | 2096334-17-5 |
| Catalog Number | AG01EHH0 |
| Chemical Name | 4-(1-Hydroxypentyl)thiophen-3-boronic acid |
| IUPAC Name | [4-(1-hydroxypentyl)thiophen-3-yl]boronic acid |
| InChI | InChI=1S/C9H15BO3S/c1-2-3-4-9(11)7-5-14-6-8(7)10(12)13/h5-6,9,11-13H,2-4H2,1H3 |
| InChI Key | FEMSXKOSNKIFME-UHFFFAOYSA-N |
| MDL Number | MFCD18783154 |
| Molecular Formula | C9H15BO3S |
| Molecular Weight | 214.0896 |
| SMILES | CCCCC(c1cscc1B(O)O)O |
| Synonyms | 4-(1-HYDROXYPENTYL)THIOPHEN-3-BORONIC ACID,
2096334-17-5,
(4-(1-Hydroxypentyl)thiophen-3-yl)boronic acid,
C9H15BO3S,
MFCD18783154,
Y2611,
A-3352,
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| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.086g/mol |
| Monoisotopic Mass | 214.083g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 88.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number