[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane

C24H32F2O4Si — CID 134931614

IUPAC[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane
SMILESCOc1ccc(COCC2C(F)(F)C2(COCc2ccc(OC)cc2)[Si](C)(C)C)cc1
InChIInChI=1S/C24H32F2O4Si/c1-27-20-10-6-18(7-11-20)14-29-16-22-23(24(22,25)26,31(3,4)5)17-30-15-19-8-12-21(28-2)13-9-19/h6-13,22H,14-17H2,1-5H3
InChIKeyVMGWEDNQJPIDDD-UHFFFAOYSA-N
MW450.60 g/mol
LogP5.78
Rot. Bonds11

About [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane

[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane (PubChem CID 134931614) has the molecular formula C24H32F2O4Si and a molecular weight of 450.60 g/mol. Its IUPAC name is [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane.

Molecular Properties

Compound Name[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane
PubChem CID134931614
Molecular FormulaC24H32F2O4Si
Molecular Weight450.60 g/mol
Exact Mass450.20
IUPAC Name[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane
SMILESCOc1ccc(COCC2C(F)(F)C2(COCc2ccc(OC)cc2)[Si](C)(C)C)cc1
InChIInChI=1S/C24H32F2O4Si/c1-27-20-10-6-18(7-11-20)14-29-16-22-23(24(22,25)26,31(3,4)5)17-30-15-19-8-12-21(28-2)13-9-19/h6-13,22H,14-17H2,1-5H3
InChIKeyVMGWEDNQJPIDDD-UHFFFAOYSA-N
XLogP5.78
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.60
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane 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

1-(2-Fluoroethoxy)-4-[(4-methoxyphenoxy)methyl]benzene
CID 76283256
1-(2-Fluoroethoxy)-4-[(4-methoxyphenyl)methoxy]benzene
CID 76283491
1-[2-[2-(2-Fluoroethoxy)ethoxy]ethoxy]-4-[(4-methoxyphenyl)methoxy]benzene
CID 126512451
1-[2-(2-Fluoroethoxy)ethoxy]-4-[(4-methoxyphenyl)methoxy]benzene
CID 127025485
1,1'-(Oxybis(methylene))bis(4-methoxybenzene)
CID 221176
1,2,3-Trifluoro-4-[(4-methoxyphenyl)methoxy]benzene
CID 156808701
1-(Cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene
CID 6482553
1-(2-(18F)fluoroethoxy)-4-[(4-methoxyphenyl)methoxy]benzene
CID 127025484
1-(2-(18F)fluoroethoxy)-4-[(4-methoxyphenoxy)methyl]benzene
CID 127026687
1-[2-[2-(2-(18F)fluoroethoxy)ethoxy]ethoxy]-4-[(4-methoxyphenyl)methoxy]benzene
CID 127029566
alpha-(Difluoromethylene)-4-methoxybenzyloxytrimethylsilane
CID 11436832
1-(Trimethylsilyloxy)-1-(4-methoxyphenyl)-2,2,2-trifluoroethane
CID 85812397

Frequently Asked Questions

What is the IUPAC name of [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane?
The IUPAC name of [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane (CID 134931614) is [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane.
What is the SMILES notation for [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane?
The canonical SMILES for [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane is COc1ccc(COCC2C(F)(F)C2(COCc2ccc(OC)cc2)[Si](C)(C)C)cc1.
What is the InChIKey of [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane?
The InChIKey is VMGWEDNQJPIDDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32F2O4Si/c1-27-20-10-6-18(7-11-20)14-29-16-22-23(24(22,25)26,31(3,4)5)17-30-15-19-8-12-21(28-2)13-9-19/h6-13,22H,14-17H2,1-5H3.
What are the key properties of [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane?
[2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane has a molecular weight of 450.60 g/mol, XLogP of 5.78, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-difluoro-1,3-bis[(4-methoxyphenyl)methoxymethyl]cyclopropyl]-trimethylsilane is sourced from PubChem (CID 134931614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).