tetrabutyl silicate;tetrakis(dimethylsilyl) silicate

C24H64O8Si6 — CID 160799729

IUPACtetrabutyl silicate;tetrakis(dimethylsilyl) silicate
SMILESCCCCO[Si](OCCCC)(OCCCC)OCCCC.C[SiH](C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C
InChIInChI=1S/C16H36O4Si.C8H28O4Si5/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;1-13(2)9-17(10-14(3)4,11-15(5)6)12-16(7)8/h5-16H2,1-4H3;13-16H,1-8H3
InChIKeySCXKEMPHSNDNKT-UHFFFAOYSA-N
MW649.28 g/mol
LogP6.11
Rot. Bonds24

About tetrabutyl silicate;tetrakis(dimethylsilyl) silicate

tetrabutyl silicate;tetrakis(dimethylsilyl) silicate (PubChem CID 160799729) has the molecular formula C24H64O8Si6 and a molecular weight of 649.28 g/mol. Its IUPAC name is tetrabutyl silicate;tetrakis(dimethylsilyl) silicate.

Molecular Properties

Compound Nametetrabutyl silicate;tetrakis(dimethylsilyl) silicate
PubChem CID160799729
Molecular FormulaC24H64O8Si6
Molecular Weight649.28 g/mol
Exact Mass648.32
IUPAC Nametetrabutyl silicate;tetrakis(dimethylsilyl) silicate
SMILESCCCCO[Si](OCCCC)(OCCCC)OCCCC.C[SiH](C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C
InChIInChI=1S/C16H36O4Si.C8H28O4Si5/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;1-13(2)9-17(10-14(3)4,11-15(5)6)12-16(7)8/h5-16H2,1-4H3;13-16H,1-8H3
InChIKeySCXKEMPHSNDNKT-UHFFFAOYSA-N
XLogP6.11
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds24
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500649.28
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

dibutyl dipentyl silicate
CID 524713
tributyl pentyl silicate
CID 524737
tributyl octyl silicate
CID 141280761
decyl trihexyl silicate
CID 141280760
triheptyl pentyl silicate
CID 141280740
nonyl tripentyl silicate
CID 141280747
dipentyl dipropyl silicate
CID 524722
3-[butoxy(dimethoxy)silyl]oxypropyl butyl dimethyl silicate
CID 141205267
diethyl dioctyl silicate
CID 154218739
tridodecyl ethyl silicate
CID 154324829
tributyl tert-butyl silicate
CID 627698
methyl tripentyl silicate
CID 524731

Frequently Asked Questions

What is the IUPAC name of tetrabutyl silicate;tetrakis(dimethylsilyl) silicate?
The IUPAC name of tetrabutyl silicate;tetrakis(dimethylsilyl) silicate (CID 160799729) is tetrabutyl silicate;tetrakis(dimethylsilyl) silicate.
What is the SMILES notation for tetrabutyl silicate;tetrakis(dimethylsilyl) silicate?
The canonical SMILES for tetrabutyl silicate;tetrakis(dimethylsilyl) silicate is CCCCO[Si](OCCCC)(OCCCC)OCCCC.C[SiH](C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C.
What is the InChIKey of tetrabutyl silicate;tetrakis(dimethylsilyl) silicate?
The InChIKey is SCXKEMPHSNDNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O4Si.C8H28O4Si5/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;1-13(2)9-17(10-14(3)4,11-15(5)6)12-16(7)8/h5-16H2,1-4H3;13-16H,1-8H3.
What are the key properties of tetrabutyl silicate;tetrakis(dimethylsilyl) silicate?
tetrabutyl silicate;tetrakis(dimethylsilyl) silicate has a molecular weight of 649.28 g/mol, XLogP of 6.11, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrabutyl silicate;tetrakis(dimethylsilyl) silicate is sourced from PubChem (CID 160799729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).