CID 88871664

C17H37BO4Si2 — CID 88871664

IUPAC—
SMILES[B][C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H37BO4Si2/c1-16(2,3)23(7,8)21-13-12(11-19)20-15(18)14(13)22-24(9,10)17(4,5)6/h12-15,19H,11H2,1-10H3/t12-,13+,14?,15-/m1/s1
InChIKeyMWTVOXFAYWDXPP-IZGVIRRGSA-N
MW372.46 g/mol
LogP3.65
Rot. Bonds5

About CID 88871664

CID 88871664 (PubChem CID 88871664) has the molecular formula C17H37BO4Si2 and a molecular weight of 372.46 g/mol.

Molecular Properties

Compound NameCID 88871664
PubChem CID88871664
Molecular FormulaC17H37BO4Si2
Molecular Weight372.46 g/mol
Exact Mass372.23
IUPAC Name—
SMILES[B][C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H37BO4Si2/c1-16(2,3)23(7,8)21-13-12(11-19)20-15(18)14(13)22-24(9,10)17(4,5)6/h12-15,19H,11H2,1-10H3/t12-,13+,14?,15-/m1/s1
InChIKeyMWTVOXFAYWDXPP-IZGVIRRGSA-N
XLogP3.65
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.46
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 88871664?
The IUPAC name of CID 88871664 (CID 88871664) is not available.
What is the SMILES notation for CID 88871664?
The canonical SMILES for CID 88871664 is [B][C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of CID 88871664?
The InChIKey is MWTVOXFAYWDXPP-IZGVIRRGSA-N. The full InChI is InChI=1S/C17H37BO4Si2/c1-16(2,3)23(7,8)21-13-12(11-19)20-15(18)14(13)22-24(9,10)17(4,5)6/h12-15,19H,11H2,1-10H3/t12-,13+,14?,15-/m1/s1.
What are the key properties of CID 88871664?
CID 88871664 has a molecular weight of 372.46 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88871664 is sourced from PubChem (CID 88871664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).