fluorosilylthiourea

CH5FN2SSi — CID 123167768

IUPACfluorosilylthiourea
SMILESNC(=S)N[SiH2]F
InChIInChI=1S/CH5FN2SSi/c2-6-4-1(3)5/h6H2,(H3,3,4,5)
InChIKeyIYOLELHQCGAREL-UHFFFAOYSA-N
MW124.22 g/mol
LogP-1.21
Rot. Bonds1

About fluorosilylthiourea

fluorosilylthiourea (PubChem CID 123167768) has the molecular formula CH5FN2SSi and a molecular weight of 124.22 g/mol. Its IUPAC name is fluorosilylthiourea.

Molecular Properties

Compound Namefluorosilylthiourea
PubChem CID123167768
Molecular FormulaCH5FN2SSi
Molecular Weight124.22 g/mol
Exact Mass123.99
IUPAC Namefluorosilylthiourea
SMILESNC(=S)N[SiH2]F
InChIInChI=1S/CH5FN2SSi/c2-6-4-1(3)5/h6H2,(H3,3,4,5)
InChIKeyIYOLELHQCGAREL-UHFFFAOYSA-N
XLogP-1.21
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.22
LogP ≤ 5-1.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(carbamothioylamino)oxythiourea
CID 174275011
CID 173119695
CID 173119695
(carbamothioylamino)carbamodithioic acid
CID 3033587
thiourea;tetrahydrobromide
CID 173150762
silane;thiourea
CID 159977961
dihydroxymethylthiourea
CID 141012549
aminothiourea;pyridine
CID 158554630
aminothiourea;dichlorocadmium;hydrate
CID 174579206
phosphorosothiourea
CID 23046632
ethylthiourea;rhenium;trihexafluorophosphate
CID 11073243
ethyl N-fluorosilylcarbamate
CID 173257923
carbamodithioic acid;indigane
CID 174684923

Frequently Asked Questions

What is the IUPAC name of fluorosilylthiourea?
The IUPAC name of fluorosilylthiourea (CID 123167768) is fluorosilylthiourea.
What is the SMILES notation for fluorosilylthiourea?
The canonical SMILES for fluorosilylthiourea is NC(=S)N[SiH2]F.
What is the InChIKey of fluorosilylthiourea?
The InChIKey is IYOLELHQCGAREL-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5FN2SSi/c2-6-4-1(3)5/h6H2,(H3,3,4,5).
What are the key properties of fluorosilylthiourea?
fluorosilylthiourea has a molecular weight of 124.22 g/mol, XLogP of -1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluorosilylthiourea is sourced from PubChem (CID 123167768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).