butyl(trichloro)silane;dichloro(diphenyl)silane

C16H19Cl5Si2 — CID 67532832

IUPACbutyl(trichloro)silane;dichloro(diphenyl)silane
SMILESCCCC[Si](Cl)(Cl)Cl.Cl[Si](Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10Cl2Si.C4H9Cl3Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4-8(5,6)7/h1-10H;2-4H2,1H3
InChIKeyHDPBJDACMUIIST-UHFFFAOYSA-N
MW444.77 g/mol
LogP6.16
Rot. Bonds5

About butyl(trichloro)silane;dichloro(diphenyl)silane

butyl(trichloro)silane;dichloro(diphenyl)silane (PubChem CID 67532832) has the molecular formula C16H19Cl5Si2 and a molecular weight of 444.77 g/mol. Its IUPAC name is butyl(trichloro)silane;dichloro(diphenyl)silane.

Molecular Properties

Compound Namebutyl(trichloro)silane;dichloro(diphenyl)silane
PubChem CID67532832
Molecular FormulaC16H19Cl5Si2
Molecular Weight444.77 g/mol
Exact Mass441.95
IUPAC Namebutyl(trichloro)silane;dichloro(diphenyl)silane
SMILESCCCC[Si](Cl)(Cl)Cl.Cl[Si](Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10Cl2Si.C4H9Cl3Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4-8(5,6)7/h1-10H;2-4H2,1H3
InChIKeyHDPBJDACMUIIST-UHFFFAOYSA-N
XLogP6.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.77
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dichloro(diphenyl)silane;octadecan-1-amine
CID 157092949
dichloro(diphenyl)silane
CID 6627
dichloro-heptyl-phenylsilane
CID 101161411
butyl-chloro-ethenyl-phenylsilane
CID 67342810
butyl-chloro-phenyl-propoxysilane
CID 140744872
N-(butyl-chloro-phenylsilyl)-N-ethylethanamine
CID 67277211
chloro-phenyl-dipropylsilane
CID 57124380
butyl-dihydroxy-phenylsilane
CID 23312649
chloro-methyl-octyl-phenylsilane
CID 66989770
chloro-hexyl-iodo-phenylsilane
CID 154486835
butyl-dimethoxy-phenylsilane
CID 66773516
[dihexyl(phenyl)silyl]-dihexyl-phenylsilane
CID 12059876

Frequently Asked Questions

What is the IUPAC name of butyl(trichloro)silane;dichloro(diphenyl)silane?
The IUPAC name of butyl(trichloro)silane;dichloro(diphenyl)silane (CID 67532832) is butyl(trichloro)silane;dichloro(diphenyl)silane.
What is the SMILES notation for butyl(trichloro)silane;dichloro(diphenyl)silane?
The canonical SMILES for butyl(trichloro)silane;dichloro(diphenyl)silane is CCCC[Si](Cl)(Cl)Cl.Cl[Si](Cl)(c1ccccc1)c1ccccc1.
What is the InChIKey of butyl(trichloro)silane;dichloro(diphenyl)silane?
The InChIKey is HDPBJDACMUIIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2Si.C4H9Cl3Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4-8(5,6)7/h1-10H;2-4H2,1H3.
What are the key properties of butyl(trichloro)silane;dichloro(diphenyl)silane?
butyl(trichloro)silane;dichloro(diphenyl)silane has a molecular weight of 444.77 g/mol, XLogP of 6.16, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(trichloro)silane;dichloro(diphenyl)silane is sourced from PubChem (CID 67532832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).