6,6-dichlorohexoxy(dipropoxy)silane

C12H26Cl2O3Si — CID 173438179

IUPAC6,6-dichlorohexoxy(dipropoxy)silane
SMILESCCCO[SiH](OCCC)OCCCCCC(Cl)Cl
InChIInChI=1S/C12H26Cl2O3Si/c1-3-9-15-18(16-10-4-2)17-11-7-5-6-8-12(13)14/h12,18H,3-11H2,1-2H3
InChIKeyRCUUIOWPQPXWEL-UHFFFAOYSA-N
MW317.33 g/mol
LogP3.94
Rot. Bonds13

About 6,6-dichlorohexoxy(dipropoxy)silane

6,6-dichlorohexoxy(dipropoxy)silane (PubChem CID 173438179) has the molecular formula C12H26Cl2O3Si and a molecular weight of 317.33 g/mol. Its IUPAC name is 6,6-dichlorohexoxy(dipropoxy)silane.

Molecular Properties

Compound Name6,6-dichlorohexoxy(dipropoxy)silane
PubChem CID173438179
Molecular FormulaC12H26Cl2O3Si
Molecular Weight317.33 g/mol
Exact Mass316.10
IUPAC Name6,6-dichlorohexoxy(dipropoxy)silane
SMILESCCCO[SiH](OCCC)OCCCCCC(Cl)Cl
InChIInChI=1S/C12H26Cl2O3Si/c1-3-9-15-18(16-10-4-2)17-11-7-5-6-8-12(13)14/h12,18H,3-11H2,1-2H3
InChIKeyRCUUIOWPQPXWEL-UHFFFAOYSA-N
XLogP3.94
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.33
LogP ≤ 53.94
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

tri(undecoxy)silane
CID 123875078
1,1-dichloroheptane
CID 13184
diethoxy(6-methylheptoxy)silane
CID 123574274
butan-1-ol;1,1-dichloroheptane
CID 88631006
1,1,6,6-tetrachlorohexane
CID 87407260
octadecoxy-di(propan-2-yloxy)silane
CID 175421908
1,1-dichloropentane;gallane
CID 174452216
chloro(dihexoxy)silane
CID 154357629
5,5-dichloropentyl acetate
CID 57290861
4-(2-dihexoxysilyloxyethyl)-N,N-diethylheptan-1-amine
CID 123243139
CID 88751239
CID 88751239
butoxy(diethoxy)silane;methanamine
CID 173001020

Frequently Asked Questions

What is the IUPAC name of 6,6-dichlorohexoxy(dipropoxy)silane?
The IUPAC name of 6,6-dichlorohexoxy(dipropoxy)silane (CID 173438179) is 6,6-dichlorohexoxy(dipropoxy)silane.
What is the SMILES notation for 6,6-dichlorohexoxy(dipropoxy)silane?
The canonical SMILES for 6,6-dichlorohexoxy(dipropoxy)silane is CCCO[SiH](OCCC)OCCCCCC(Cl)Cl.
What is the InChIKey of 6,6-dichlorohexoxy(dipropoxy)silane?
The InChIKey is RCUUIOWPQPXWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26Cl2O3Si/c1-3-9-15-18(16-10-4-2)17-11-7-5-6-8-12(13)14/h12,18H,3-11H2,1-2H3.
What are the key properties of 6,6-dichlorohexoxy(dipropoxy)silane?
6,6-dichlorohexoxy(dipropoxy)silane has a molecular weight of 317.33 g/mol, XLogP of 3.94, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dichlorohexoxy(dipropoxy)silane is sourced from PubChem (CID 173438179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).