Chemical Properties of Phosphorothioic acid, s-ester with n-[4-[(3-hydroxypropyl)amino]butyl]phthalimide (CAS 31786-68-2)

Phosphorothioic acid, s-ester with n-[4-[(3-hydroxypropyl)amino]butyl]phthalimide

InChI
InChI=1S/C15H21N2O5PS/c18-14-12-6-1-2-7-13(12)15(19)17(14)10-4-3-8-16-9-5-11-24-23(20,21)22/h1-2,6-7,16H,3-5,8-11H2,(H2,20,21,22)
InChI Key
XTLLEHXVVHCTOQ-UHFFFAOYSA-N
Formula
C15H21N2O5PS
SMILES
O=C1c2ccccc2C(=O)N1CCCCNCCCSP(=O)(O)O
Molecular Weight1
372.38
CAS
31786-68-2
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Physical Properties

Property Value Unit Source
ω 1.2355 Relay (1.0) Calculated Property
ΔfG° -341.38 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -813.94 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 143.12 kJ/mol Relay (1.0) Calculated Property
IE 9.22 eV Relay (1.0) Calculated Property
log10WS -1.79 Relay (1.0) Calculated Property
logPoct/wat 1.868 Crippen Calculated Property
McVol 265.110 ml/mol McGowan Calculated Property
Pc 1482.80 kPa Relay (1.0-beta) Calculated Property
Tboil 733.79 K Relay (1.0) Calculated Property
Tc 1055.96 K Relay (1.0) Calculated Property
Tfus 394.43 K Relay (1.0) Calculated Property
Vc 0.952 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Phthalimide, n-[4-(tetrahydro-2-oxo-2h-1,3-oxazin-3-yl)butyl]-. Phthalimide, N-[4-(2-oxo-3-oxazolidinyl)butyl]-. Dimetindene M (nor, OH), acetylated. Cytosine arabinoside, methyl-TMS derivative. Cytosine arabinoside, dimethyl-propyldimethylsilyl derivative. Metopon. 11-Ketoestradiol (enol), TMS. Benazepril Me. Retroisosensine. Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. ethyl eburnamenine-14-carboxylate. Retroisosenine. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv.. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Tetrabenazine M (desmethyl-HO-), monoacetylated.

Find more compounds similar to Phosphorothioic acid, s-ester with n-[4-[(3-hydroxypropyl)amino]butyl]phthalimide.

Sources

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