2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole

C10H21BOSi — CID 597424

IUPAC2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole
SMILESCCB1O[Si](C)(CC)C(C)=C1CC
InChIInChI=1S/C10H21BOSi/c1-6-10-9(4)13(5,8-3)12-11(10)7-2/h6-8H2,1-5H3
InChIKeyLQQBPMXEOGDPAL-UHFFFAOYSA-N
MW196.17 g/mol
LogP3.43
Rot. Bonds3

About 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole

2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole (PubChem CID 597424) has the molecular formula C10H21BOSi and a molecular weight of 196.17 g/mol. Its IUPAC name is 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole.

Molecular Properties

Compound Name2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole
PubChem CID597424
Molecular FormulaC10H21BOSi
Molecular Weight196.17 g/mol
Exact Mass196.15
IUPAC Name2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole
SMILESCCB1O[Si](C)(CC)C(C)=C1CC
InChIInChI=1S/C10H21BOSi/c1-6-10-9(4)13(5,8-3)12-11(10)7-2/h6-8H2,1-5H3
InChIKeyLQQBPMXEOGDPAL-UHFFFAOYSA-N
XLogP3.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.17
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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
2-(Dimethyl(methoxy)silyl)-3-(ethylmethoxyboryl)-2-pentene
CID 607907
5-Ethoxy-4-ethyl-2,5-dihydro-2,2,3-trimethyl-1,2,5-oxasilaborole
CID 13329734
4,5,5-Triethyl-2,2,3-trimethyl-1-oxonia-2-sila-5-boranuidacyclopent-3-ene
CID 14872838
2,4,5,5-Tetraethyl-2,3-dimethyl-1-oxonia-2-sila-5-boranuidacyclopent-3-ene
CID 14872843
CID 176440313
CID 176440313
CID 176440314
CID 176440314
1,2,5-Oxasilaborole, 5-tert-butyl-4-ethyl-2,2,3-trimethyl-2,5-dihydro-
CID 592787
1-Selena-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 608947

Frequently Asked Questions

What is the IUPAC name of 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole?
The IUPAC name of 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole (CID 597424) is 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole.
What is the SMILES notation for 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole?
The canonical SMILES for 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole is CCB1O[Si](C)(CC)C(C)=C1CC.
What is the InChIKey of 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole?
The InChIKey is LQQBPMXEOGDPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21BOSi/c1-6-10-9(4)13(5,8-3)12-11(10)7-2/h6-8H2,1-5H3.
What are the key properties of 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole?
2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole has a molecular weight of 196.17 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-triethyl-2,3-dimethyl-1,2,5-oxasilaborole is sourced from PubChem (CID 597424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).