CID 10921880

C10H23BNOSi — CID 10921880

IUPAC
SMILES[B-][N+]1(CCO[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C10H23BNOSi/c1-10(2,3)14(4,5)13-9-8-12(11)6-7-12/h6-9H2,1-5H3
InChIKeyFWIXFLHOHNIFMV-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.92
Rot. Bonds4

About CID 10921880

CID 10921880 (PubChem CID 10921880) has the molecular formula C10H23BNOSi and a molecular weight of 212.20 g/mol.

Molecular Properties

Compound NameCID 10921880
PubChem CID10921880
Molecular FormulaC10H23BNOSi
Molecular Weight212.20 g/mol
Exact Mass212.16
IUPAC Name
SMILES[B-][N+]1(CCO[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C10H23BNOSi/c1-10(2,3)14(4,5)13-9-8-12(11)6-7-12/h6-9H2,1-5H3
InChIKeyFWIXFLHOHNIFMV-UHFFFAOYSA-N
XLogP1.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 10921880?
The IUPAC name of CID 10921880 (CID 10921880) is not available.
What is the SMILES notation for CID 10921880?
The canonical SMILES for CID 10921880 is [B-][N+]1(CCO[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of CID 10921880?
The InChIKey is FWIXFLHOHNIFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23BNOSi/c1-10(2,3)14(4,5)13-9-8-12(11)6-7-12/h6-9H2,1-5H3.
What are the key properties of CID 10921880?
CID 10921880 has a molecular weight of 212.20 g/mol, XLogP of 1.92, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10921880 is sourced from PubChem (CID 10921880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).