CID 68534782

C11H15F2Si — CID 68534782

IUPAC—
SMILESCc1ccc(C)c(CCC[Si](F)F)c1
InChIInChI=1S/C11H15F2Si/c1-9-5-6-10(2)11(8-9)4-3-7-14(12)13/h5-6,8H,3-4,7H2,1-2H3
InChIKeySXFWMIFAMAFKJK-UHFFFAOYSA-N
MW213.32 g/mol
LogP3.66
Rot. Bonds4

About CID 68534782

CID 68534782 (PubChem CID 68534782) has the molecular formula C11H15F2Si and a molecular weight of 213.32 g/mol.

Molecular Properties

Compound NameCID 68534782
PubChem CID68534782
Molecular FormulaC11H15F2Si
Molecular Weight213.32 g/mol
Exact Mass213.09
IUPAC Name—
SMILESCc1ccc(C)c(CCC[Si](F)F)c1
InChIInChI=1S/C11H15F2Si/c1-9-5-6-10(2)11(8-9)4-3-7-14(12)13/h5-6,8H,3-4,7H2,1-2H3
InChIKeySXFWMIFAMAFKJK-UHFFFAOYSA-N
XLogP3.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 53.66
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'}

Analyze CID 68534782 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-butyl-1,4-dimethylbenzene;ethane;ethene
CID 177226937
1,4-dimethyl-2-(3-propoxypropyl)benzene
CID 121277387
CID 68591460
CID 68591460
2-[2-[2-[2-(2,5-dimethylphenyl)ethyl]phenyl]ethyl]-1,4-dimethylbenzene
CID 132604430
2-(2-chloroethyl)-1,4-dimethylbenzene
CID 53403519
2-(fluoromethyl)-1,4-dimethylbenzene
CID 15724447
4-(2,5-dimethylphenyl)butane-1-sulfonyl chloride
CID 98702218
bromo-[6-(2,5-dimethylphenyl)hexyl]-dimethyl-λ4-sulfane
CID 58078184
6-(2,5-dimethylphenyl)hexan-3-one
CID 64522526
cesium 4-(2,5-dimethylphenyl)butanoate
CID 140689556
2-(2,5-dimethylphenyl)-N-ethylethanamine
CID 62537525
2-(2-cyclohexylethyl)-1,4-dimethylbenzene
CID 59184196

Frequently Asked Questions

What is the IUPAC name of CID 68534782?
The IUPAC name of CID 68534782 (CID 68534782) is not available.
What is the SMILES notation for CID 68534782?
The canonical SMILES for CID 68534782 is Cc1ccc(C)c(CCC[Si](F)F)c1.
What is the InChIKey of CID 68534782?
The InChIKey is SXFWMIFAMAFKJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2Si/c1-9-5-6-10(2)11(8-9)4-3-7-14(12)13/h5-6,8H,3-4,7H2,1-2H3.
What are the key properties of CID 68534782?
CID 68534782 has a molecular weight of 213.32 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68534782 is sourced from PubChem (CID 68534782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).