Chemical Properties of Methylthiophosphonic acid, O-ethyl, S-(8-diisopropylamino)-1,3,6-trithiaoctyl ester

InChI

InChI=1S/C14H32NO2PS4/c1-7-17-18(6,16)22-21-12-20-11-10-19-9-8-15(13(2)3)14(4)5/h13-14H,7-12H2,1-6H3

InChI Key

XFIORCMIGKMUNX-UHFFFAOYSA-N

Formula

C14H32NO2PS4

SMILES

CCOP(C)(=O)SSCSCCSCCN(C(C)C)C(C)C

Molecular Weight¹

405.64

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-6.86		Crippen Calculated Property
logPoct/wat	5.770		Crippen Calculated Property
McVol	315.700	ml/mol	McGowan Calculated Property
Inp	[2628.00; 2628.00]
Inp	2628.00		NIST
Inp	2628.00		NIST

Similar Compounds

Find more compounds similar to Methylthiophosphonic acid, O-ethyl, S-(8-diisopropylamino)-1,3,6-trithiaoctyl ester.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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