[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane

C20H36O2Si — CID 172997536

IUPAC[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane
SMILESCCCO[SiH](OCCC)C1=C(C2=CCCCCC2)CCCCC1
InChIInChI=1S/C20H36O2Si/c1-3-16-21-23(22-17-4-2)20-15-11-7-10-14-19(20)18-12-8-5-6-9-13-18/h12,23H,3-11,13-17H2,1-2H3
InChIKeySRGCHTJBNKRHQR-UHFFFAOYSA-N
MW336.59 g/mol
LogP5.75
Rot. Bonds8

About [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane

[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane (PubChem CID 172997536) has the molecular formula C20H36O2Si and a molecular weight of 336.59 g/mol. Its IUPAC name is [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane.

Molecular Properties

Compound Name[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane
PubChem CID172997536
Molecular FormulaC20H36O2Si
Molecular Weight336.59 g/mol
Exact Mass336.25
IUPAC Name[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane
SMILESCCCO[SiH](OCCC)C1=C(C2=CCCCCC2)CCCCC1
InChIInChI=1S/C20H36O2Si/c1-3-16-21-23(22-17-4-2)20-15-11-7-10-14-19(20)18-12-8-5-6-9-13-18/h12,23H,3-11,13-17H2,1-2H3
InChIKeySRGCHTJBNKRHQR-UHFFFAOYSA-N
XLogP5.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.59
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
1-(cyclodecen-1-yl)cyclodecene
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1-(cyclopenten-1-yl)cyclooctene
CID 91463872
1-(cyclohepten-1-yl)cycloheptene;trichloro(ethyl)silane
CID 67277470
1-pentylcyclododecene
CID 150654776
chloro-ethyl-dimethylsilane;1-(cyclohepten-1-yl)cycloheptene
CID 66646162
1-(cyclohepten-1-yl)-2-propoxyethanamine
CID 106652723
1-hexylcycloheptene
CID 15587826
1-nonylcyclooctene
CID 151486862
CID 67945351
CID 67945351
2-(cyclohexen-1-yl)cyclohexene-1-carboxylate
CID 22364197
dibutoxy-(2-methylcyclopenten-1-yl)silane
CID 123447319

Frequently Asked Questions

What is the IUPAC name of [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane?
The IUPAC name of [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane (CID 172997536) is [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane.
What is the SMILES notation for [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane?
The canonical SMILES for [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane is CCCO[SiH](OCCC)C1=C(C2=CCCCCC2)CCCCC1.
What is the InChIKey of [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane?
The InChIKey is SRGCHTJBNKRHQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36O2Si/c1-3-16-21-23(22-17-4-2)20-15-11-7-10-14-19(20)18-12-8-5-6-9-13-18/h12,23H,3-11,13-17H2,1-2H3.
What are the key properties of [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane?
[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane has a molecular weight of 336.59 g/mol, XLogP of 5.75, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane is sourced from PubChem (CID 172997536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).