[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane

C17H21ClOSi — CID 103438613

IUPAC[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane
SMILESCc1cc(Cl)ccc1OCc1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C17H21ClOSi/c1-13-11-15(18)7-10-17(13)19-12-14-5-8-16(9-6-14)20(2,3)4/h5-11H,12H2,1-4H3
InChIKeyKMWKPCSJYIDVQJ-UHFFFAOYSA-N
MW304.89 g/mol
LogP4.77
Rot. Bonds4

About [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane

[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane (PubChem CID 103438613) has the molecular formula C17H21ClOSi and a molecular weight of 304.89 g/mol. Its IUPAC name is [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane
PubChem CID103438613
Molecular FormulaC17H21ClOSi
Molecular Weight304.89 g/mol
Exact Mass304.11
IUPAC Name[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane
SMILESCc1cc(Cl)ccc1OCc1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C17H21ClOSi/c1-13-11-15(18)7-10-17(13)19-12-14-5-8-16(9-6-14)20(2,3)4/h5-11H,12H2,1-4H3
InChIKeyKMWKPCSJYIDVQJ-UHFFFAOYSA-N
XLogP4.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.89
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl 4-[(4-chloro-2-methylphenoxy)methyl]benzoate
CID 28825626
[4-[(4-chlorophenyl)methoxy]-3-methylphenyl]-(4-methylphenyl)diazene
CID 10736623
4,6-dichloro-2-[(4-chloro-2-methylphenoxy)methyl]pyrimidine
CID 82169650
[5-[(4-chloro-2-methylphenoxy)methyl]-1,2-oxazol-3-yl]methanamine
CID 62458540
2-[4-[(4-chlorophenyl)methoxy]-3-methylphenyl]acetic acid
CID 82051602
potassium [4-[(4-chlorophenyl)methoxy]-3-methylphenyl]-trifluoroboranuide
CID 63676426
3-[4-[(4-chlorophenyl)methoxy]-3-methylphenyl]prop-2-yn-1-ol
CID 63214756
5-[(4-chloro-2-methylphenoxy)methyl]-2-methoxybenzoic acid
CID 65339281
4-[(4-chloro-2-methylphenoxy)methyl]pyridine-2-carboxylic acid
CID 63885169
4-chloro-2-[(4-chloro-2-methylphenoxy)methyl]aniline
CID 79582746
5-chloro-2-[(4-methylphenyl)methoxy]aniline
CID 19624539
5-chloro-2-[(4-chloro-2-methylphenoxy)methyl]aniline
CID 62101754

Frequently Asked Questions

What is the IUPAC name of [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane?
The IUPAC name of [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane (CID 103438613) is [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane is Cc1cc(Cl)ccc1OCc1ccc([Si](C)(C)C)cc1.
What is the InChIKey of [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane?
The InChIKey is KMWKPCSJYIDVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClOSi/c1-13-11-15(18)7-10-17(13)19-12-14-5-8-16(9-6-14)20(2,3)4/h5-11H,12H2,1-4H3.
What are the key properties of [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane?
[4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane has a molecular weight of 304.89 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-chloro-2-methylphenoxy)methyl]phenyl]-trimethylsilane is sourced from PubChem (CID 103438613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).