2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane

C115H162B4Cl6O47Si3 — CID 158102576

About 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane

2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane (PubChem CID 158102576) has the molecular formula C115H162B4Cl6O47Si3 and a molecular weight of 2636.74 g/mol. Its IUPAC name is 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane.

Molecular Properties

• Compound Name: 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane
• PubChem CID: 158102576
• Molecular Formula: C115H162B4Cl6O47Si3
• Molecular Weight: 2636.74 g/mol
• Exact Mass: 2632.81
• IUPAC Name: 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane
• SMILES: CC(=O)OC[C@H]1O[C@@H](c2ccc(B(Cl)Cl)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](c2ccc([Si](C)(C)C)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC1(C)OB(Cl)OC1(C)C.CO[C@@]1(c2ccc([Si](C)(C)C)cc2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.CO[C@@]1(c2ccc([Si](C)(C)C)cc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O.ClB(Cl)Cl
• InChI: InChI=1S/C26H35BO11.C24H34O10Si.C23H32O9Si.C20H23BCl2O9.C16H26O6Si.C6H12BClO2.BCl3/c1-14(28)32-13-20-22(33-15(2)29)24(35-17(4)31)23(34-16(3)30)21(36-20)18-9-11-19(12-10-18)27-37-25(5,6)26(7,8)38-27;1-14(25)30-13-20-21(31-15(2)26)22(32-16(3)27)23(33-17(4)28)24(29-5,34-20)18-9-11-19(12-10-18)35(6,7)8;1-13(24)28-12-19-21(29-14(2)25)23(31-16(4)27)22(30-15(3)26)20(32-19)17-8-10-18(11-9-17)33(5,6)7;1-10(24)28-9-16-18(29-11(2)25)20(31-13(4)27)19(30-12(3)26)17(32-16)14-5-7-15(8-6-14)21(22)23;1-21-16(10-5-7-11(8-6-10)23(2,3)4)15(20)14(19)13(18)12(9-17)22-16;1-5(2)6(3,4)10-7(8)9-5;2-1(3)4/h9-12,20-24H,13H2,1-8H3;9-12,20-23H,13H2,1-8H3;8-11,19-23H,12H2,1-7H3;5-8,16-20H,9H2,1-4H3;5-8,12-15,17-20H,9H2,1-4H3;1-4H3;/t20-,21+,22-,23+,24+;20-,21-,22+,23-,24+;19-,20+,21-,22+,23+;16-,17+,18-,19+,20+;12-,13-,14+,15-,16+;;/m11111../s1
• InChIKey: FPLDENQUFHUVLV-IJDFRNKNSA-N
• XLogP: 10.27
• TPSA: 603.25 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 47
• Rotatable Bonds: 33
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2636.74
LogP ≤ 5	10.27
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane?

The IUPAC name of 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane (CID 158102576) is 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane.

What is the SMILES notation for 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane?

The canonical SMILES for 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane is CC(=O)OC[C@H]1O[C@@H](c2ccc(B(Cl)Cl)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](c2ccc([Si](C)(C)C)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CC1(C)OB(Cl)OC1(C)C.CO[C@@]1(c2ccc([Si](C)(C)C)cc2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.CO[C@@]1(c2ccc([Si](C)(C)C)cc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O.ClB(Cl)Cl.

What is the InChIKey of 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane?

The InChIKey is FPLDENQUFHUVLV-IJDFRNKNSA-N. The full InChI is InChI=1S/C26H35BO11.C24H34O10Si.C23H32O9Si.C20H23BCl2O9.C16H26O6Si.C6H12BClO2.BCl3/c1-14(28)32-13-20-22(33-15(2)29)24(35-17(4)31)23(34-16(3)30)21(36-20)18-9-11-19(12-10-18)27-37-25(5,6)26(7,8)38-27;1-14(25)30-13-20-21(31-15(2)26)22(32-16(3)27)23(33-17(4)28)24(29-5,34-20)18-9-11-19(12-10-18)35(6,7)8;1-13(24)28-12-19-21(29-14(2)25)23(31-16(4)27)22(30-15(3)26)20(32-19)17-8-10-18(11-9-17)33(5,6)7;1-10(24)28-9-16-18(29-11(2)25)20(31-13(4)27)19(30-12(3)26)17(32-16)14-5-7-15(8-6-14)21(22)23;1-21-16(10-5-7-11(8-6-10)23(2,3)4)15(20)14(19)13(18)12(9-17)22-16;1-5(2)6(3,4)10-7(8)9-5;2-1(3)4/h9-12,20-24H,13H2,1-8H3;9-12,20-23H,13H2,1-8H3;8-11,19-23H,12H2,1-7H3;5-8,16-20H,9H2,1-4H3;5-8,12-15,17-20H,9H2,1-4H3;1-4H3;/t20-,21+,22-,23+,24+;20-,21-,22+,23-,24+;19-,20+,21-,22+,23+;16-,17+,18-,19+,20+;12-,13-,14+,15-,16+;;/m11111../s1.

What are the key properties of 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane?

2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane has a molecular weight of 2636.74 g/mol, XLogP of 10.27, 33 rotatable bonds, 4 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2-methoxy-2-(4-trimethylsilylphenyl)oxane-3,4,5-triol;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-dichloroboranylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-methoxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxan-2-yl]methyl acetate;[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-(4-trimethylsilylphenyl)oxan-2-yl]methyl acetate;trichloroborane is sourced from PubChem (CID 158102576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).