Chemical Properties of Thieno[3,2-c]pyridine, 5-[(2-chlorophenyl)methyl]-4,5,6,7-tetrahydro- (CAS 55142-85-3)

Thieno[3,2-c]pyridine, 5-[(2-chlorophenyl)methyl]-4,5,6,7-tetrahydro-

InChI
InChI=1S/C14H14ClNS/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14/h1-4,6,8H,5,7,9-10H2
InChI Key
PHWBOXQYWZNQIN-UHFFFAOYSA-N
Formula
C14H14ClNS
SMILES
Clc1ccccc1CN1CCc2sccc2C1
Molecular Weight1
263.79
CAS
55142-85-3
Other Names
  • Thieno(3,2-c)pyridine, 4,5,6,7-tetrahydro-5-((2-chlorophenyl)methyl)-
  • 5-((2-Chlorophenyl)methyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine
  • PCR 5332
  • Ticlopidine
  • 5-(O-Chlorobenzyl)-4,5,6,7-tetrahydrothieno-[3,2-c]pyridine
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Physical Properties

Property Value Unit Source
ω 0.4781 Relay (1.0) Calculated Property
ΔfG° 306.73 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 183.26 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 98.86 kJ/mol Relay (1.0) Calculated Property
IE 8.33 eV Relay (1.0) Calculated Property
log10WS -3.45 Relay (1.0) Calculated Property
logPoct/wat 3.960 Crippen Calculated Property
McVol 192.610 ml/mol McGowan Calculated Property
Pc 2573.95 kPa Relay (1.0-beta) Calculated Property
Inp 2090.00 NIST
Tboil 633.69 K Relay (1.0) Calculated Property
Tc 890.18 K Relay (1.0) Calculated Property
Tfus 346.42 K Relay (1.0) Calculated Property
Vc 0.693 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

(2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Oxycodone. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. risperidone. Oxycodone TMS derivative. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Oxycodone, trimethylsilyl ether. Oxymorphone. Tetrabenazine M (desmethyl-HO-), monoacetylated. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Oxymorphone, bis(trimethylsilyl) ether. Naloxone. Naltrexone.

Find more compounds similar to Thieno[3,2-c]pyridine, 5-[(2-chlorophenyl)methyl]-4,5,6,7-tetrahydro-.

Sources

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