dichloro(propylsulfanyl)phosphane

C3H7Cl2PS — CID 13354512

IUPACdichloro(propylsulfanyl)phosphane
SMILESCCCSP(Cl)Cl
InChIInChI=1S/C3H7Cl2PS/c1-2-3-7-6(4)5/h2-3H2,1H3
InChIKeyQGTQJFKPGPXFGL-UHFFFAOYSA-N
MW177.04 g/mol
LogP3.83
Rot. Bonds3

About dichloro(propylsulfanyl)phosphane

dichloro(propylsulfanyl)phosphane (PubChem CID 13354512) has the molecular formula C3H7Cl2PS and a molecular weight of 177.04 g/mol. Its IUPAC name is dichloro(propylsulfanyl)phosphane.

Molecular Properties

Compound Namedichloro(propylsulfanyl)phosphane
PubChem CID13354512
Molecular FormulaC3H7Cl2PS
Molecular Weight177.04 g/mol
Exact Mass175.94
IUPAC Namedichloro(propylsulfanyl)phosphane
SMILESCCCSP(Cl)Cl
InChIInChI=1S/C3H7Cl2PS/c1-2-3-7-6(4)5/h2-3H2,1H3
InChIKeyQGTQJFKPGPXFGL-UHFFFAOYSA-N
XLogP3.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.04
LogP ≤ 53.83
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

Isopropyl sulphenyl chloride
CID 11116012
Propyl sulfenyl chloride
CID 12535950
S-butyl thiodichlorophosphite
CID 15651677
Phosphorodichloridodithioic acid, propyl ester
CID 79347
Phosphorodichloridodithioic acid, S-ethyl ester
CID 519205
Ethyl dichlorothiophosphite
CID 12539851
Trichloro(propyl)-lambda4-sulfane
CID 53741400
Trichloro(ethyl)-lambda4-sulfane
CID 89359584
Trichloro(propan-2-yl)-lambda4-sulfane
CID 134928446
(Ethylthio)phosphorous chloride
CID 129812286
Dichloro-propan-2-ylsulfanyl-sulfanylidene-lambda5-phosphane
CID 21425230
1,2-Propanedisulfenyl dichloride
CID 21513516

Frequently Asked Questions

What is the IUPAC name of dichloro(propylsulfanyl)phosphane?
The IUPAC name of dichloro(propylsulfanyl)phosphane (CID 13354512) is dichloro(propylsulfanyl)phosphane.
What is the SMILES notation for dichloro(propylsulfanyl)phosphane?
The canonical SMILES for dichloro(propylsulfanyl)phosphane is CCCSP(Cl)Cl.
What is the InChIKey of dichloro(propylsulfanyl)phosphane?
The InChIKey is QGTQJFKPGPXFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7Cl2PS/c1-2-3-7-6(4)5/h2-3H2,1H3.
What are the key properties of dichloro(propylsulfanyl)phosphane?
dichloro(propylsulfanyl)phosphane has a molecular weight of 177.04 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(propylsulfanyl)phosphane is sourced from PubChem (CID 13354512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).