hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane

C8H18O2Si — CID 54205394

IUPAChydroxy-dimethyl-(3-prop-2-enoxypropyl)silane
SMILESC=CCOCCC[Si](C)(C)O
InChIInChI=1S/C8H18O2Si/c1-4-6-10-7-5-8-11(2,3)9/h4,9H,1,5-8H2,2-3H3
InChIKeyKHPWFHMYXDLIMY-UHFFFAOYSA-N
MW174.32 g/mol
LogP1.78
Rot. Bonds6

About hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane

hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane (PubChem CID 54205394) has the molecular formula C8H18O2Si and a molecular weight of 174.32 g/mol. Its IUPAC name is hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane.

Molecular Properties

Compound Namehydroxy-dimethyl-(3-prop-2-enoxypropyl)silane
PubChem CID54205394
Molecular FormulaC8H18O2Si
Molecular Weight174.32 g/mol
Exact Mass174.11
IUPAC Namehydroxy-dimethyl-(3-prop-2-enoxypropyl)silane
SMILESC=CCOCCC[Si](C)(C)O
InChIInChI=1S/C8H18O2Si/c1-4-6-10-7-5-8-11(2,3)9/h4,9H,1,5-8H2,2-3H3
InChIKeyKHPWFHMYXDLIMY-UHFFFAOYSA-N
XLogP1.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane?
The IUPAC name of hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane (CID 54205394) is hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane.
What is the SMILES notation for hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane?
The canonical SMILES for hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane is C=CCOCCC[Si](C)(C)O.
What is the InChIKey of hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane?
The InChIKey is KHPWFHMYXDLIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2Si/c1-4-6-10-7-5-8-11(2,3)9/h4,9H,1,5-8H2,2-3H3.
What are the key properties of hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane?
hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane has a molecular weight of 174.32 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-(3-prop-2-enoxypropyl)silane is sourced from PubChem (CID 54205394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).