(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane

C13H28O2Si — CID 14967380

IUPAC(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane
SMILESCC1OC1CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H28O2Si/c1-9(2)16(10(3)4,11(5)6)14-8-13-12(7)15-13/h9-13H,8H2,1-7H3
InChIKeyMEELTCHKASFTAK-UHFFFAOYSA-N
MW244.45 g/mol
LogP3.97
Rot. Bonds6

About (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane

(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane (PubChem CID 14967380) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane
PubChem CID14967380
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane
SMILESCC1OC1CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H28O2Si/c1-9(2)16(10(3)4,11(5)6)14-8-13-12(7)15-13/h9-13H,8H2,1-7H3
InChIKeyMEELTCHKASFTAK-UHFFFAOYSA-N
XLogP3.97
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane?
The IUPAC name of (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane (CID 14967380) is (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane.
What is the SMILES notation for (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane?
The canonical SMILES for (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane is CC1OC1CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane?
The InChIKey is MEELTCHKASFTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-9(2)16(10(3)4,11(5)6)14-8-13-12(7)15-13/h9-13H,8H2,1-7H3.
What are the key properties of (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane?
(3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane has a molecular weight of 244.45 g/mol, XLogP of 3.97, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyloxiran-2-yl)methoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 14967380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).