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

C11H19F3OSi — CID 175097953

IUPAC(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
SMILESCC=CC1([SiH2]CCC(F)(F)F)CCCCO1
InChIInChI=1S/C11H19F3OSi/c1-2-5-10(6-3-4-8-15-10)16-9-7-11(12,13)14/h2,5H,3-4,6-9,16H2,1H3
InChIKeyNZRRHKIYWPTUDE-UHFFFAOYSA-N
MW252.35 g/mol
LogP3.00
Rot. Bonds4

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

(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane (PubChem CID 175097953) has the molecular formula C11H19F3OSi and a molecular weight of 252.35 g/mol. Its IUPAC name is (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Name(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
PubChem CID175097953
Molecular FormulaC11H19F3OSi
Molecular Weight252.35 g/mol
Exact Mass252.12
IUPAC Name(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
SMILESCC=CC1([SiH2]CCC(F)(F)F)CCCCO1
InChIInChI=1S/C11H19F3OSi/c1-2-5-10(6-3-4-8-15-10)16-9-7-11(12,13)14/h2,5H,3-4,6-9,16H2,1H3
InChIKeyNZRRHKIYWPTUDE-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.00
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 (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The IUPAC name of (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane (CID 175097953) is (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane is CC=CC1([SiH2]CCC(F)(F)F)CCCCO1.
What is the InChIKey of (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
The InChIKey is NZRRHKIYWPTUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3OSi/c1-2-5-10(6-3-4-8-15-10)16-9-7-11(12,13)14/h2,5H,3-4,6-9,16H2,1H3.
What are the key properties of (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane?
(2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane has a molecular weight of 252.35 g/mol, XLogP of 3.00, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-prop-1-enyloxan-2-yl)-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 175097953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).