cycloheptylmethyl-dimethoxy-propan-2-ylsilane

C13H28O2Si — CID 18412972

IUPACcycloheptylmethyl-dimethoxy-propan-2-ylsilane
SMILESCO[Si](CC1CCCCCC1)(OC)C(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2)16(14-3,15-4)11-13-9-7-5-6-8-10-13/h12-13H,5-11H2,1-4H3
InChIKeyNKKJRPBQBPANNQ-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.10
Rot. Bonds5

About cycloheptylmethyl-dimethoxy-propan-2-ylsilane

cycloheptylmethyl-dimethoxy-propan-2-ylsilane (PubChem CID 18412972) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is cycloheptylmethyl-dimethoxy-propan-2-ylsilane.

Molecular Properties

Compound Namecycloheptylmethyl-dimethoxy-propan-2-ylsilane
PubChem CID18412972
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Namecycloheptylmethyl-dimethoxy-propan-2-ylsilane
SMILESCO[Si](CC1CCCCCC1)(OC)C(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2)16(14-3,15-4)11-13-9-7-5-6-8-10-13/h12-13H,5-11H2,1-4H3
InChIKeyNKKJRPBQBPANNQ-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.10
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

bis(cyclopentylmethyl)-dimethoxysilane
CID 18413024
cycloheptylmethyl-(cyclohexylmethoxy)-methoxy-methylsilane
CID 139996965
2-ethoxypropylcyclohexane
CID 57126788
2-cyclohexylethoxy-(cyclohexylmethyl)-dimethoxysilane
CID 175077365
cyclobutylmethoxy-(cyclopentylmethyl)-methoxy-methylsilane
CID 139996961
[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane
CID 123752911
cyclodecyl-cyclohexyl-dimethoxysilane
CID 139768404
bis(2-methylpropylcyclohexane);2-methylpropylcyclopentane
CID 159474199
2-cyclopentylethyl(trimethoxy)silane
CID 22412540
2-(cyclooctylmethoxy)ethyl-tri(propan-2-yl)silane
CID 70179025
(2S)-1-cyclohexyl-N-methoxypropan-2-amine
CID 54506563
2-cyclohexylethyl-hydroxy-dimethoxysilane
CID 20712687

Frequently Asked Questions

What is the IUPAC name of cycloheptylmethyl-dimethoxy-propan-2-ylsilane?
The IUPAC name of cycloheptylmethyl-dimethoxy-propan-2-ylsilane (CID 18412972) is cycloheptylmethyl-dimethoxy-propan-2-ylsilane.
What is the SMILES notation for cycloheptylmethyl-dimethoxy-propan-2-ylsilane?
The canonical SMILES for cycloheptylmethyl-dimethoxy-propan-2-ylsilane is CO[Si](CC1CCCCCC1)(OC)C(C)C.
What is the InChIKey of cycloheptylmethyl-dimethoxy-propan-2-ylsilane?
The InChIKey is NKKJRPBQBPANNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-12(2)16(14-3,15-4)11-13-9-7-5-6-8-10-13/h12-13H,5-11H2,1-4H3.
What are the key properties of cycloheptylmethyl-dimethoxy-propan-2-ylsilane?
cycloheptylmethyl-dimethoxy-propan-2-ylsilane has a molecular weight of 244.45 g/mol, XLogP of 4.10, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptylmethyl-dimethoxy-propan-2-ylsilane is sourced from PubChem (CID 18412972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).