| CAS Number | 1310048-95-3 |
| Catalog Number | AG00A02C(AGN-PC-0WBOIF) |
| Chemical Name | 1,3,2-Dioxaborolane, 2-[(3-fluorophenyl)methyl]-4,4,5,5-tetramethyl- |
| IUPAC Name | 2-[(3-fluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H18BFO2/c1-12(2)13(3,4)17-14(16-12)9-10-6-5-7-11(15)8-10/h5-8H,9H2,1-4H3 |
| InChI Key | LIQLVQAWDJTUIM-UHFFFAOYSA-N |
| MDL Number | MFCD10698518 |
| Molecular Formula | C13H18BFO2 |
| Molecular Weight | 236.0902 |
| SMILES | C(B1OC(C(O1)(C)C)(C)C)c1cc(F)ccc1 |
| Synonyms | 1310048-95-3,
2-(3-FLUOROBENZYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE,
3-Fluorophenylmethylboronic acid pinacol ester,
(3-FLUOROBENZYL)BORONIC ACID PINACOL ESTER,
4785AH,
MFCD10698518,
ZINC170017012,
AB62281,
CS-W004353,
AM805714,
AS-39605,
J-005921,
C13H18BFO2,
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| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.138g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.093g/mol |
| Monoisotopic Mass | 236.138g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^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