triheptyl(propan-2-yloxy)silane

C24H52OSi — CID 178181529

IUPACtriheptyl(propan-2-yloxy)silane
SMILESCCCCCCC[Si](CCCCCCC)(CCCCCCC)OC(C)C
InChIInChI=1S/C24H52OSi/c1-6-9-12-15-18-21-26(25-24(4)5,22-19-16-13-10-7-2)23-20-17-14-11-8-3/h24H,6-23H2,1-5H3
InChIKeyQHCYWJAAIJQXJF-UHFFFAOYSA-N
MW384.77 g/mol
LogP9.27
Rot. Bonds20

About triheptyl(propan-2-yloxy)silane

triheptyl(propan-2-yloxy)silane (PubChem CID 178181529) has the molecular formula C24H52OSi and a molecular weight of 384.77 g/mol. Its IUPAC name is triheptyl(propan-2-yloxy)silane.

Molecular Properties

Compound Nametriheptyl(propan-2-yloxy)silane
PubChem CID178181529
Molecular FormulaC24H52OSi
Molecular Weight384.77 g/mol
Exact Mass384.38
IUPAC Nametriheptyl(propan-2-yloxy)silane
SMILESCCCCCCC[Si](CCCCCCC)(CCCCCCC)OC(C)C
InChIInChI=1S/C24H52OSi/c1-6-9-12-15-18-21-26(25-24(4)5,22-19-16-13-10-7-2)23-20-17-14-11-8-3/h24H,6-23H2,1-5H3
InChIKeyQHCYWJAAIJQXJF-UHFFFAOYSA-N
XLogP9.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.77
LogP ≤ 59.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

decyl-ethyl-di(propan-2-yloxy)silane
CID 158736144
dibutyl-(chloromethyl)-propan-2-yloxysilane
CID 23146703
hexadecyl-dimethoxy-propan-2-yloxysilane
CID 154147118
ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
trihexyl-[(E)-oct-3-en-2-yl]oxysilane
CID 5353195
methanethioic S-acid;octyl-tri(propan-2-yloxy)silane
CID 175341627
trihexyl(hex-4-yn-3-yloxy)silane
CID 531316
[bis(2-methylpropyl)-octadecylsilyl]oxysilyloxy-bis(2-methylpropyl)-octadecylsilane
CID 123807674
trihexadecyl(propoxy)silane
CID 172579393
dibutyl-methyl-propan-2-yloxysilane
CID 87144451
diethyl-hexyl-methoxysilane
CID 59112330
decyl-tris(2-methylpropoxy)silane
CID 163237532

Frequently Asked Questions

What is the IUPAC name of triheptyl(propan-2-yloxy)silane?
The IUPAC name of triheptyl(propan-2-yloxy)silane (CID 178181529) is triheptyl(propan-2-yloxy)silane.
What is the SMILES notation for triheptyl(propan-2-yloxy)silane?
The canonical SMILES for triheptyl(propan-2-yloxy)silane is CCCCCCC[Si](CCCCCCC)(CCCCCCC)OC(C)C.
What is the InChIKey of triheptyl(propan-2-yloxy)silane?
The InChIKey is QHCYWJAAIJQXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52OSi/c1-6-9-12-15-18-21-26(25-24(4)5,22-19-16-13-10-7-2)23-20-17-14-11-8-3/h24H,6-23H2,1-5H3.
What are the key properties of triheptyl(propan-2-yloxy)silane?
triheptyl(propan-2-yloxy)silane has a molecular weight of 384.77 g/mol, XLogP of 9.27, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triheptyl(propan-2-yloxy)silane is sourced from PubChem (CID 178181529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).