dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane

C10H17PS — CID 91466135

IUPACdimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
SMILESCC.CP(C)(=S)c1ccccc1
InChIInChI=1S/C8H11PS.C2H6/c1-9(2,10)8-6-4-3-5-7-8;1-2/h3-7H,1-2H3;1-2H3
InChIKeyZBGNVBCVMQUNQT-UHFFFAOYSA-N
MW200.29 g/mol
LogP3.08
Rot. Bonds1

About dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane

dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane (PubChem CID 91466135) has the molecular formula C10H17PS and a molecular weight of 200.29 g/mol. Its IUPAC name is dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane.

Molecular Properties

Compound Namedimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
PubChem CID91466135
Molecular FormulaC10H17PS
Molecular Weight200.29 g/mol
Exact Mass200.08
IUPAC Namedimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
SMILESCC.CP(C)(=S)c1ccccc1
InChIInChI=1S/C8H11PS.C2H6/c1-9(2,10)8-6-4-3-5-7-8;1-2/h3-7H,1-2H3;1-2H3
InChIKeyZBGNVBCVMQUNQT-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl-phenyl-sulfanyl-sulfanylidene-lambda5-phosphane
CID 586594
CID 50986602
CID 50986602
ethane;methane;[methyl(phenyl)phosphoryl]benzene
CID 162150444
methoxy-methyl-phenyl-sulfanylidene-λ5-phosphane
CID 12650712
(3-bromophenyl)-dimethyl-sulfanylidene-λ5-phosphane
CID 154728396
bromo-diphenyl-sulfanylidene-λ5-phosphane
CID 23415811
Diphenylselenothiophosphinic acid
CID 11243432
oxido-diphenyl-sulfanylidene-λ5-phosphane
CID 3382215
hydroxy-diphenyl-sulfanylidene-λ5-phosphane;hydrochloride
CID 172809471
(2-methylphenyl)-diphenyl-sulfanylidene-lambda5-phosphane
CID 13238195
phenyl-dipropyl-sulfanylidene-λ5-phosphane
CID 135075774
methyl-naphthalen-2-yl-phenyl-sulfanylidene-λ5-phosphane
CID 23421632

Frequently Asked Questions

What is the IUPAC name of dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane?
The IUPAC name of dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane (CID 91466135) is dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane.
What is the SMILES notation for dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane?
The canonical SMILES for dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane is CC.CP(C)(=S)c1ccccc1.
What is the InChIKey of dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane?
The InChIKey is ZBGNVBCVMQUNQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11PS.C2H6/c1-9(2,10)8-6-4-3-5-7-8;1-2/h3-7H,1-2H3;1-2H3.
What are the key properties of dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane?
dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane has a molecular weight of 200.29 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane is sourced from PubChem (CID 91466135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).