3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane

C20H23F17SiSn — CID 177417658

IUPAC3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane
SMILESC[Si](C)(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C1([Sn](C)(C)C)C=CC=C1
InChIInChI=1S/C17H14F17Si.3CH3.Sn/c1-35(2,9-5-3-4-6-9)8-7-10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34;;;;/h3-6H,7-8H2,1-2H3;3*1H3;
InChIKeyRJDVPLLIWYATJZ-UHFFFAOYSA-N
MW733.17 g/mol
LogP9.84
Rot. Bonds11

About 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 177417658) has the molecular formula C20H23F17SiSn and a molecular weight of 733.17 g/mol. Its IUPAC name is 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Name3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane
PubChem CID177417658
Molecular FormulaC20H23F17SiSn
Molecular Weight733.17 g/mol
Exact Mass734.03
IUPAC Name3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane
SMILESC[Si](C)(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C1([Sn](C)(C)C)C=CC=C1
InChIInChI=1S/C17H14F17Si.3CH3.Sn/c1-35(2,9-5-3-4-6-9)8-7-10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34;;;;/h3-6H,7-8H2,1-2H3;3*1H3;
InChIKeyRJDVPLLIWYATJZ-UHFFFAOYSA-N
XLogP9.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500733.17
LogP ≤ 59.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane (CID 177417658) is 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane is C[Si](C)(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C1([Sn](C)(C)C)C=CC=C1.
What is the InChIKey of 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is RJDVPLLIWYATJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F17Si.3CH3.Sn/c1-35(2,9-5-3-4-6-9)8-7-10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34;;;;/h3-6H,7-8H2,1-2H3;3*1H3;.
What are the key properties of 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane?
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 733.17 g/mol, XLogP of 9.84, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl-dimethyl-(1-trimethylstannylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 177417658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).