trichloro-(4-methoxyphenyl)silane

C7H7Cl3OSi — CID 13219757

IUPACtrichloro-(4-methoxyphenyl)silane
SMILESCOc1ccc([Si](Cl)(Cl)Cl)cc1
InChIInChI=1S/C7H7Cl3OSi/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3
InChIKeyNNWMTCDMYFZDHA-UHFFFAOYSA-N
MW241.58 g/mol
LogP2.56
Rot. Bonds2

About trichloro-(4-methoxyphenyl)silane

trichloro-(4-methoxyphenyl)silane (PubChem CID 13219757) has the molecular formula C7H7Cl3OSi and a molecular weight of 241.58 g/mol. Its IUPAC name is trichloro-(4-methoxyphenyl)silane.

Molecular Properties

Compound Nametrichloro-(4-methoxyphenyl)silane
PubChem CID13219757
Molecular FormulaC7H7Cl3OSi
Molecular Weight241.58 g/mol
Exact Mass239.93
IUPAC Nametrichloro-(4-methoxyphenyl)silane
SMILESCOc1ccc([Si](Cl)(Cl)Cl)cc1
InChIInChI=1S/C7H7Cl3OSi/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3
InChIKeyNNWMTCDMYFZDHA-UHFFFAOYSA-N
XLogP2.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.58
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-bis(4-methoxyphenyl)silane
CID 15847326
trichloro-(4-propan-2-yloxyphenyl)silane
CID 69462595
trichloro-(4-trimethoxysilylphenyl)silane
CID 59207169
dichloro-cyclohexyl-(4-methoxyphenyl)silane
CID 15514740
trichloro-[(4-methoxyphenyl)methyl]silane
CID 11482253
3-chloro-7-methoxyisoquinoline
CID 53425565
1,4-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173452430
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
3-chloro-6-methoxyisoquinoline
CID 53407774
4-chloro-6-(4-methoxyphenyl)sulfanylpyrimidine
CID 61280001
CID 177393997
CID 177393997
1-(113C)methoxy-4-methylbenzene
CID 166176950

Frequently Asked Questions

What is the IUPAC name of trichloro-(4-methoxyphenyl)silane?
The IUPAC name of trichloro-(4-methoxyphenyl)silane (CID 13219757) is trichloro-(4-methoxyphenyl)silane.
What is the SMILES notation for trichloro-(4-methoxyphenyl)silane?
The canonical SMILES for trichloro-(4-methoxyphenyl)silane is COc1ccc([Si](Cl)(Cl)Cl)cc1.
What is the InChIKey of trichloro-(4-methoxyphenyl)silane?
The InChIKey is NNWMTCDMYFZDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl3OSi/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3.
What are the key properties of trichloro-(4-methoxyphenyl)silane?
trichloro-(4-methoxyphenyl)silane has a molecular weight of 241.58 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-(4-methoxyphenyl)silane is sourced from PubChem (CID 13219757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).