4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole

C9H19BSeSi — CID 608947

IUPAC4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole
SMILESCCB1[Se][Si](C)(C)C(C)=C1CC
InChIInChI=1S/C9H19BSeSi/c1-6-9-8(3)12(4,5)11-10(9)7-2/h6-7H2,1-5H3
InChIKeyVOLWMNDCOPUPQS-UHFFFAOYSA-N
MW245.11 g/mol
LogP2.73
Rot. Bonds2

About 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole

4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole (PubChem CID 608947) has the molecular formula C9H19BSeSi and a molecular weight of 245.11 g/mol. Its IUPAC name is 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole.

Molecular Properties

Compound Name4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole
PubChem CID608947
Molecular FormulaC9H19BSeSi
Molecular Weight245.11 g/mol
Exact Mass246.05
IUPAC Name4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole
SMILESCCB1[Se][Si](C)(C)C(C)=C1CC
InChIInChI=1S/C9H19BSeSi/c1-6-9-8(3)12(4,5)11-10(9)7-2/h6-7H2,1-5H3
InChIKeyVOLWMNDCOPUPQS-UHFFFAOYSA-N
XLogP2.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-Oxa-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 574206
2-Pentene, 3-diethylboryl-2-trimethylsilyl-
CID 5366484
3-Hexene, 3-diethylboryl-4-trimethylsilyl-
CID 5366485
[(E)-3-diethylboranylpent-2-en-2-yl]-ethyl-dimethylsilane
CID 14436714
1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 593224
1-Oxa-2-sila-5-boracyclopent-3-ene, 2,4,5-triethyl-2,3-dimethyl-
CID 597424
2-Pentene, 2-ethyldimethylsilyl-3-diethylboryl-
CID 5368101
2-Pentene, 3-diethylboryl-2-(chloromethylsilyl)-
CID 6329070
2-Pentene, 3-diethylboryl-2-dimethylsilyl-
CID 6329169
2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-
CID 6329565
[(Z)-4-diethylboranylhex-3-en-3-yl]-trimethylsilane
CID 14436718
[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane
CID 12871273

Frequently Asked Questions

What is the IUPAC name of 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole?
The IUPAC name of 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole (CID 608947) is 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole.
What is the SMILES notation for 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole?
The canonical SMILES for 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole is CCB1[Se][Si](C)(C)C(C)=C1CC.
What is the InChIKey of 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole?
The InChIKey is VOLWMNDCOPUPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19BSeSi/c1-6-9-8(3)12(4,5)11-10(9)7-2/h6-7H2,1-5H3.
What are the key properties of 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole?
4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole has a molecular weight of 245.11 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diethyl-2,2,3-trimethyl-1,2,5-selenasilaborole is sourced from PubChem (CID 608947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).