methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane

C12H21F3OSi — CID 173239499

IUPACmethyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
SMILESCC=CC1([SiH](C)CCC(F)(F)F)CCCCO1
InChIInChI=1S/C12H21F3OSi/c1-3-6-11(7-4-5-9-16-11)17(2)10-8-12(13,14)15/h3,6,17H,4-5,7-10H2,1-2H3
InChIKeyYHJNUKXBKBMDJY-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.85
Rot. Bonds4

About methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane

methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane (PubChem CID 173239499) has the molecular formula C12H21F3OSi and a molecular weight of 266.38 g/mol. Its IUPAC name is methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Namemethyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
PubChem CID173239499
Molecular FormulaC12H21F3OSi
Molecular Weight266.38 g/mol
Exact Mass266.13
IUPAC Namemethyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
SMILESCC=CC1([SiH](C)CCC(F)(F)F)CCCCO1
InChIInChI=1S/C12H21F3OSi/c1-3-6-11(7-4-5-9-16-11)17(2)10-8-12(13,14)15/h3,6,17H,4-5,7-10H2,1-2H3
InChIKeyYHJNUKXBKBMDJY-UHFFFAOYSA-N
XLogP3.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The IUPAC name of methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane (CID 173239499) is methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane is CC=CC1([SiH](C)CCC(F)(F)F)CCCCO1.
What is the InChIKey of methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The InChIKey is YHJNUKXBKBMDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3OSi/c1-3-6-11(7-4-5-9-16-11)17(2)10-8-12(13,14)15/h3,6,17H,4-5,7-10H2,1-2H3.
What are the key properties of methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane has a molecular weight of 266.38 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 173239499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).