[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane

C17H42O6Si3 — CID 123257611

IUPAC[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane
SMILESCO[SiH](OC)C(C)CC(C)(CC(C)[SiH](OC)OC)CC(C)[SiH](OC)OC
InChIInChI=1S/C17H42O6Si3/c1-14(24(18-5)19-6)11-17(4,12-15(2)25(20-7)21-8)13-16(3)26(22-9)23-10/h14-16,24-26H,11-13H2,1-10H3
InChIKeyQIGZCIALIBUWCS-UHFFFAOYSA-N
MW426.78 g/mol
LogP2.87
Rot. Bonds15

About [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane

[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane (PubChem CID 123257611) has the molecular formula C17H42O6Si3 and a molecular weight of 426.78 g/mol. Its IUPAC name is [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane.

Molecular Properties

Compound Name[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane
PubChem CID123257611
Molecular FormulaC17H42O6Si3
Molecular Weight426.78 g/mol
Exact Mass426.23
IUPAC Name[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane
SMILESCO[SiH](OC)C(C)CC(C)(CC(C)[SiH](OC)OC)CC(C)[SiH](OC)OC
InChIInChI=1S/C17H42O6Si3/c1-14(24(18-5)19-6)11-17(4,12-15(2)25(20-7)21-8)13-16(3)26(22-9)23-10/h14-16,24-26H,11-13H2,1-10H3
InChIKeyQIGZCIALIBUWCS-UHFFFAOYSA-N
XLogP2.87
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.78
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

dimethoxy(4,4,4-trifluorobutan-2-yl)silane
CID 123462688
butan-2-yl(dimethoxy)silane;propane
CID 173302238
tris(2-dimethoxysilylpropyl)-methoxysilane
CID 154071556
3,3-dimethylpentan-2-yl(dimethoxy)silane
CID 173004269
dimethoxy(tridecan-2-yl)silane
CID 174991319
4-(3-dimethoxysilylbutyltrisulfanyl)butan-2-yl-dimethoxysilane
CID 154083059
1-N,4-N-bis(3-dimethoxysilylbutyl)benzene-1,4-diamine
CID 154194478
di(propan-2-yloxy)-(4,4,4-trifluorobutan-2-yl)silane
CID 173041525
8-dimethoxysilyl-N-(3-dimethoxysilylbutyl)nonan-1-amine
CID 175409014
N,N'-bis(3-dimethoxysilylbutyl)-N,N'-dimethyloctane-1,8-diamine
CID 172714286
ethyl N-(2-dimethoxysilylpropyl)carbamate
CID 154176562
(1-chloro-3-methylbutyl)-dimethoxysilane
CID 123501518

Frequently Asked Questions

What is the IUPAC name of [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane?
The IUPAC name of [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane (CID 123257611) is [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane.
What is the SMILES notation for [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane?
The canonical SMILES for [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane is CO[SiH](OC)C(C)CC(C)(CC(C)[SiH](OC)OC)CC(C)[SiH](OC)OC.
What is the InChIKey of [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane?
The InChIKey is QIGZCIALIBUWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H42O6Si3/c1-14(24(18-5)19-6)11-17(4,12-15(2)25(20-7)21-8)13-16(3)26(22-9)23-10/h14-16,24-26H,11-13H2,1-10H3.
What are the key properties of [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane?
[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane has a molecular weight of 426.78 g/mol, XLogP of 2.87, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane is sourced from PubChem (CID 123257611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).