dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane

C10H21Cl3Si — CID 11425849

IUPACdichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane
SMILESCC(C)(Cl)CC(C)(C)CC[Si](C)(Cl)Cl
InChIInChI=1S/C10H21Cl3Si/c1-9(2,8-10(3,4)11)6-7-14(5,12)13/h6-8H2,1-5H3
InChIKeyHHUXPZKOAQRKGW-UHFFFAOYSA-N
MW275.72 g/mol
LogP5.36
Rot. Bonds5

About dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane

dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane (PubChem CID 11425849) has the molecular formula C10H21Cl3Si and a molecular weight of 275.72 g/mol. Its IUPAC name is dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane.

Molecular Properties

Compound Namedichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane
PubChem CID11425849
Molecular FormulaC10H21Cl3Si
Molecular Weight275.72 g/mol
Exact Mass274.05
IUPAC Namedichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane
SMILESCC(C)(Cl)CC(C)(C)CC[Si](C)(Cl)Cl
InChIInChI=1S/C10H21Cl3Si/c1-9(2,8-10(3,4)11)6-7-14(5,12)13/h6-8H2,1-5H3
InChIKeyHHUXPZKOAQRKGW-UHFFFAOYSA-N
XLogP5.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.72
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dichloro-methyl-(3,3,3-trifluoropropyl)silane
CID 159011444
dichloro-methyl-(3,3,3-trifluoropropyl)silane
CID 12666
2-chloro-2,4,4-trimethylhexane
CID 58017854
dichloro-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-nonadecafluoroundecyl)silane
CID 101217112
dichloro-[5-[dichloro(methyl)silyl]pentyl]-methylsilane
CID 154317252
5-[dichloro(methyl)silyl]-2,4,4-trimethylpentan-2-amine
CID 90829279
1,4-bis(6-chloro-2,4,4,6-tetramethylheptan-2-yl)benzene
CID 22975899
2-(4-chloro-2,4-dimethylpentan-2-yl)oxirane
CID 123310397
chloromethane;dichloro(dimethyl)silane
CID 88615851
dichloro-[[dichloro(methyl)silyl]methyl]-methylsilane
CID 13131405
dichloro-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-octacosafluorooctadec-17-enyl)silane;trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-octacosafluorooctadec-17-enyl)silane
CID 91593862
trichloro-[1-chloro-1-[dichloro(methyl)silyl]ethyl]silane
CID 12509030

Frequently Asked Questions

What is the IUPAC name of dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane?
The IUPAC name of dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane (CID 11425849) is dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane.
What is the SMILES notation for dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane?
The canonical SMILES for dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane is CC(C)(Cl)CC(C)(C)CC[Si](C)(Cl)Cl.
What is the InChIKey of dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane?
The InChIKey is HHUXPZKOAQRKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21Cl3Si/c1-9(2,8-10(3,4)11)6-7-14(5,12)13/h6-8H2,1-5H3.
What are the key properties of dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane?
dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane has a molecular weight of 275.72 g/mol, XLogP of 5.36, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane is sourced from PubChem (CID 11425849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).