trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane

C15H24O2Si — CID 141423011

IUPACtrimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane
SMILESC[Si](C)(C)c1ccccc1CCCOCC1CO1
InChIInChI=1S/C15H24O2Si/c1-18(2,3)15-9-5-4-7-13(15)8-6-10-16-11-14-12-17-14/h4-5,7,9,14H,6,8,10-12H2,1-3H3
InChIKeyJKTLOWCVUWAQJO-UHFFFAOYSA-N
MW264.44 g/mol
LogP2.58
Rot. Bonds7

About trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane

trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane (PubChem CID 141423011) has the molecular formula C15H24O2Si and a molecular weight of 264.44 g/mol. Its IUPAC name is trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane
PubChem CID141423011
Molecular FormulaC15H24O2Si
Molecular Weight264.44 g/mol
Exact Mass264.15
IUPAC Nametrimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane
SMILESC[Si](C)(C)c1ccccc1CCCOCC1CO1
InChIInChI=1S/C15H24O2Si/c1-18(2,3)15-9-5-4-7-13(15)8-6-10-16-11-14-12-17-14/h4-5,7,9,14H,6,8,10-12H2,1-3H3
InChIKeyJKTLOWCVUWAQJO-UHFFFAOYSA-N
XLogP2.58
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(4-propylphenyl)propoxymethyl]oxirane
CID 160627488
hydroxy-methyl-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane
CID 101402997
[4-[dimethyl-[3-(oxiran-2-ylmethoxy)propyl]silyl]phenyl]-dimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 14419243
2-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxymethyl]oxirane
CID 130476668
2-[4-[4-[4-[4-[4-[4-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxymethyl]oxirane
CID 130476685
2-[18-(oxiran-2-ylmethoxy)octadecoxymethyl]oxirane
CID 172718038
2-[3-[3-[[3,5-bis[3-(oxiran-2-ylmethoxy)propyl]phenyl]methyl]-5-[3-(oxiran-2-ylmethoxy)propyl]phenyl]propoxymethyl]oxirane
CID 175238935
dibutoxy-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane
CID 139765356
diethoxy-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane;silane
CID 157211120
ethane-1,2-diol;2-nonylphenol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 88792258
1-ethoxy-2-nonylbenzene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 88512513
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane?
The IUPAC name of trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane (CID 141423011) is trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane.
What is the SMILES notation for trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane?
The canonical SMILES for trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane is C[Si](C)(C)c1ccccc1CCCOCC1CO1.
What is the InChIKey of trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane?
The InChIKey is JKTLOWCVUWAQJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2Si/c1-18(2,3)15-9-5-4-7-13(15)8-6-10-16-11-14-12-17-14/h4-5,7,9,14H,6,8,10-12H2,1-3H3.
What are the key properties of trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane?
trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane has a molecular weight of 264.44 g/mol, XLogP of 2.58, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[3-(oxiran-2-ylmethoxy)propyl]phenyl]silane is sourced from PubChem (CID 141423011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).