difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)

C19H55F2N9O4S3Si — CID 159762304

IUPACdifluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)
SMILESCN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.[O-][Si]([O-])([O-])OC(F)F
InChIInChI=1S/3C6H18N3S.CHF2O4Si/c3*1-7(2)10(8(3)4)9(5)6;2-1(3)7-8(4,5)6/h3*1-6H3;1H/q3*+1;-3
InChIKeyNFAXUNMUHPEKPU-UHFFFAOYSA-N
MW635.99 g/mol
LogP-3.15
Rot. Bonds11

About difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)

difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium) (PubChem CID 159762304) has the molecular formula C19H55F2N9O4S3Si and a molecular weight of 635.99 g/mol. Its IUPAC name is difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium).

Molecular Properties

Compound Namedifluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)
PubChem CID159762304
Molecular FormulaC19H55F2N9O4S3Si
Molecular Weight635.99 g/mol
Exact Mass635.33
IUPAC Namedifluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)
SMILESCN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.[O-][Si]([O-])([O-])OC(F)F
InChIInChI=1S/3C6H18N3S.CHF2O4Si/c3*1-7(2)10(8(3)4)9(5)6;2-1(3)7-8(4,5)6/h3*1-6H3;1H/q3*+1;-3
InChIKeyNFAXUNMUHPEKPU-UHFFFAOYSA-N
XLogP-3.15
TPSA107.57 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds11
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500635.99
LogP ≤ 5-3.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)?
The IUPAC name of difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium) (CID 159762304) is difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium).
What is the SMILES notation for difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)?
The canonical SMILES for difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium) is CN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.CN(C)[S+](N(C)C)N(C)C.[O-][Si]([O-])([O-])OC(F)F.
What is the InChIKey of difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)?
The InChIKey is NFAXUNMUHPEKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H18N3S.CHF2O4Si/c3*1-7(2)10(8(3)4)9(5)6;2-1(3)7-8(4,5)6/h3*1-6H3;1H/q3*+1;-3.
What are the key properties of difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium)?
difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium) has a molecular weight of 635.99 g/mol, XLogP of -3.15, 11 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for difluoromethoxy(trioxido)silane;tris(tris(dimethylamino)sulfanium) is sourced from PubChem (CID 159762304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).