trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane

C14H21NO3Si — CID 100938985

IUPACtrimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane
SMILESC[Si](C)(C)ON1OCC2COC(c3ccccc3)C21
InChIInChI=1S/C14H21NO3Si/c1-19(2,3)18-15-13-12(10-17-15)9-16-14(13)11-7-5-4-6-8-11/h4-8,12-14H,9-10H2,1-3H3
InChIKeyHHQVFCANCIUZCA-UHFFFAOYSA-N
MW279.41 g/mol
LogP2.76
Rot. Bonds3

About trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane

trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane (PubChem CID 100938985) has the molecular formula C14H21NO3Si and a molecular weight of 279.41 g/mol. Its IUPAC name is trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane.

Molecular Properties

Compound Nametrimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane
PubChem CID100938985
Molecular FormulaC14H21NO3Si
Molecular Weight279.41 g/mol
Exact Mass279.13
IUPAC Nametrimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane
SMILESC[Si](C)(C)ON1OCC2COC(c3ccccc3)C21
InChIInChI=1S/C14H21NO3Si/c1-19(2,3)18-15-13-12(10-17-15)9-16-14(13)11-7-5-4-6-8-11/h4-8,12-14H,9-10H2,1-3H3
InChIKeyHHQVFCANCIUZCA-UHFFFAOYSA-N
XLogP2.76
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 52.76
H-Bond Donors ≤ 50
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 trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane?
The IUPAC name of trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane (CID 100938985) is trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane.
What is the SMILES notation for trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane?
The canonical SMILES for trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane is C[Si](C)(C)ON1OCC2COC(c3ccccc3)C21.
What is the InChIKey of trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane?
The InChIKey is HHQVFCANCIUZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3Si/c1-19(2,3)18-15-13-12(10-17-15)9-16-14(13)11-7-5-4-6-8-11/h4-8,12-14H,9-10H2,1-3H3.
What are the key properties of trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane?
trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane has a molecular weight of 279.41 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(6-phenyl-3a,4,6,6a-tetrahydro-3H-furo[3,4-c][1,2]oxazol-1-yl)oxy]silane is sourced from PubChem (CID 100938985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).