CID 101385940

C6H20BNSi2+ — CID 101385940

IUPAC—
SMILESB[N+]([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C6H20BNSi2/c1-9(2,3)8(7)10(4,5)6/h7H2,1-6H3/q+1
InChIKeyGZBDSVXXBTVQIS-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.34
Rot. Bonds2

About CID 101385940

CID 101385940 (PubChem CID 101385940) has the molecular formula C6H20BNSi2+ and a molecular weight of 173.22 g/mol.

Molecular Properties

Compound NameCID 101385940
PubChem CID101385940
Molecular FormulaC6H20BNSi2+
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name—
SMILESB[N+]([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C6H20BNSi2/c1-9(2,3)8(7)10(4,5)6/h7H2,1-6H3/q+1
InChIKeyGZBDSVXXBTVQIS-UHFFFAOYSA-N
XLogP1.34
TPSA5.90 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 101385940?
The IUPAC name of CID 101385940 (CID 101385940) is not available.
What is the SMILES notation for CID 101385940?
The canonical SMILES for CID 101385940 is B[N+]([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of CID 101385940?
The InChIKey is GZBDSVXXBTVQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H20BNSi2/c1-9(2,3)8(7)10(4,5)6/h7H2,1-6H3/q+1.
What are the key properties of CID 101385940?
CID 101385940 has a molecular weight of 173.22 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101385940 is sourced from PubChem (CID 101385940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).