butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane

C10H16Cl2F6OSi — CID 88739785

IUPACbutyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane
SMILESCCCC[Si](Cl)(Cl)C(F)(OCCC)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H16Cl2F6OSi/c1-3-5-7-20(11,12)10(18,19-6-4-2)8(13,14)9(15,16)17/h3-7H2,1-2H3
InChIKeyGMPMGKHCXFDETK-UHFFFAOYSA-N
MW365.22 g/mol
LogP5.54
Rot. Bonds8

About butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane

butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane (PubChem CID 88739785) has the molecular formula C10H16Cl2F6OSi and a molecular weight of 365.22 g/mol. Its IUPAC name is butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane.

Molecular Properties

Compound Namebutyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane
PubChem CID88739785
Molecular FormulaC10H16Cl2F6OSi
Molecular Weight365.22 g/mol
Exact Mass364.03
IUPAC Namebutyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane
SMILESCCCC[Si](Cl)(Cl)C(F)(OCCC)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H16Cl2F6OSi/c1-3-5-7-20(11,12)10(18,19-6-4-2)8(13,14)9(15,16)17/h3-7H2,1-2H3
InChIKeyGMPMGKHCXFDETK-UHFFFAOYSA-N
XLogP5.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.22
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,2,2,3,3,5,5,5-decafluoro-4-propoxy-4-(trifluoromethyl)pentane
CID 15006619
1,1,1,2,2,3,3,4,4,5,5,6-dodecafluoro-6-propoxyheptane
CID 87689733
2-butoxy-1,1,1,2,3,3,4,4,5,5,5-undecafluoropentane
CID 151204416
butyl-chloro-phenyl-propoxysilane
CID 140744872
dibutoxy-(1,1,2,2,3,3,3-heptafluoropropyl)-methylsilane
CID 141324690
1-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptoxy)octane
CID 71328605
dibutyl-[3-[dibutyl(propoxy)silyl]propyl]-propoxysilane
CID 87145187
2-[difluoro(propoxy)methyl]-1,1,1,2,3,3,3-heptafluoropropane
CID 22450708
trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane
CID 156769582
butyl-chloro-ethoxy-propoxysilane
CID 140745078
1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-propoxy-2-(trifluoromethyl)octane
CID 135287934
1,1,2,2,3-pentafluoro-3-methyl-1-propoxybutane
CID 175046926

Frequently Asked Questions

What is the IUPAC name of butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane?
The IUPAC name of butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane (CID 88739785) is butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane.
What is the SMILES notation for butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane?
The canonical SMILES for butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane is CCCC[Si](Cl)(Cl)C(F)(OCCC)C(F)(F)C(F)(F)F.
What is the InChIKey of butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane?
The InChIKey is GMPMGKHCXFDETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Cl2F6OSi/c1-3-5-7-20(11,12)10(18,19-6-4-2)8(13,14)9(15,16)17/h3-7H2,1-2H3.
What are the key properties of butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane?
butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane has a molecular weight of 365.22 g/mol, XLogP of 5.54, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dichloro-(1,2,2,3,3,3-hexafluoro-1-propoxypropyl)silane is sourced from PubChem (CID 88739785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).