2-bromoethoxy-dimethoxy-pentylsilane

C9H21BrO3Si — CID 142614027

IUPAC2-bromoethoxy-dimethoxy-pentylsilane
SMILESCCCCC[Si](OC)(OC)OCCBr
InChIInChI=1S/C9H21BrO3Si/c1-4-5-6-9-14(11-2,12-3)13-8-7-10/h4-9H2,1-3H3
InChIKeyISGKCSKPQMOIME-UHFFFAOYSA-N
MW285.25 g/mol
LogP2.82
Rot. Bonds9

About 2-bromoethoxy-dimethoxy-pentylsilane

2-bromoethoxy-dimethoxy-pentylsilane (PubChem CID 142614027) has the molecular formula C9H21BrO3Si and a molecular weight of 285.25 g/mol. Its IUPAC name is 2-bromoethoxy-dimethoxy-pentylsilane.

Molecular Properties

Compound Name2-bromoethoxy-dimethoxy-pentylsilane
PubChem CID142614027
Molecular FormulaC9H21BrO3Si
Molecular Weight285.25 g/mol
Exact Mass284.04
IUPAC Name2-bromoethoxy-dimethoxy-pentylsilane
SMILESCCCCC[Si](OC)(OC)OCCBr
InChIInChI=1S/C9H21BrO3Si/c1-4-5-6-9-14(11-2,12-3)13-8-7-10/h4-9H2,1-3H3
InChIKeyISGKCSKPQMOIME-UHFFFAOYSA-N
XLogP2.82
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.25
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

butoxy-butyl-dimethoxysilane
CID 139714527
3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
CID 156751574
hexacosyl(trimethoxy)silane
CID 150262252
azane;trimethoxy(pentyl)silane
CID 19608931
4-bromobutyl(trimethoxy)silane
CID 15433593
trimethoxy(pentacontyl)silane
CID 87930715
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
25-bromopentacosyl(trimethoxy)silane
CID 87680868
22-bromodocosyl(trimethoxy)silane
CID 87682578
trimethoxy(undecyl)silane;hydrobromide
CID 172731268

Frequently Asked Questions

What is the IUPAC name of 2-bromoethoxy-dimethoxy-pentylsilane?
The IUPAC name of 2-bromoethoxy-dimethoxy-pentylsilane (CID 142614027) is 2-bromoethoxy-dimethoxy-pentylsilane.
What is the SMILES notation for 2-bromoethoxy-dimethoxy-pentylsilane?
The canonical SMILES for 2-bromoethoxy-dimethoxy-pentylsilane is CCCCC[Si](OC)(OC)OCCBr.
What is the InChIKey of 2-bromoethoxy-dimethoxy-pentylsilane?
The InChIKey is ISGKCSKPQMOIME-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21BrO3Si/c1-4-5-6-9-14(11-2,12-3)13-8-7-10/h4-9H2,1-3H3.
What are the key properties of 2-bromoethoxy-dimethoxy-pentylsilane?
2-bromoethoxy-dimethoxy-pentylsilane has a molecular weight of 285.25 g/mol, XLogP of 2.82, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromoethoxy-dimethoxy-pentylsilane is sourced from PubChem (CID 142614027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).