Chemical Properties of 7-Chloro-s-triazolopyrimidine-5(1H)-one

7-Chloro-s-triazolopyrimidine-5(1H)-one

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InChI
InChI=1S/C5H3ClN4O/c6-3-1-4(11)10-5(9-3)7-2-8-10/h1-2H,(H,7,8,9)
InChI Key
OIMZPIMUQKSKGZ-UHFFFAOYSA-N
Formula
C5H3ClN4O
SMILES
O=c1cc(Cl)nc2nc[nH]n12
Molecular Weight1
170.56
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Physical Properties

Property Value Unit Source
ω 0.5150 Relay (... Calculated Property
ΔfG° 214.83 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas 58.57 kJ/mol Relay (... Calculated Property
ΔvapH° 100.56 kJ/mol Relay (... Calculated Property
IE 9.25 eV Relay (... Calculated Property
log10WS -1.94 Relay (... Calculated Property
logPoct/wat -0.411 Crippen Calculated Property
McVol 100.420 ml/mol McGowan Calculated Property
Pc 6042.41 kPa Relay (... Calculated Property ⚠️
Inp 1669.00 NIST
Tboil 611.41 K Relay (... Calculated Property
Tc 902.70 K Relay (... Calculated Property
Tfus 547.84 K Relay (... Calculated Property
Vc 0.388 m3/kmol Relay (... Calculated Property

Similar Compounds

6-Methyl-4-oxo-1,3,3a,7-tetrazaindene. Carteolol, acetylated. Hypoxanthine deoxyriboside, TMS. Pindolol tbdms. Inosine, 2',3',5'-tribenzoate. 1H-Pyrazolo[4,3-d]pyrimidine, 7-amino-3-«beta»-D-ribofuranosyl-. 5«alpha»-Androstan-17«alpha»-methyl-4«beta»,17«beta»-diol-3,2c-pyrazol, TMS. 4'-Hydroxystanozolol (5A-Androstan-17A-methyl-4',17B-diol-3,2c-pyrazol), TMS. cytidine, TMS. Trichlormethiazide. Penbutolol, TBDMS. Adenosine, 2-methoxy-. Cytidine, 2',3',5'-tris(trimethylsilyl) ether. 10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydro-indolo-[2,3-c]-quinazo-[3,2,a]-pyridine. Carteolol hydroxy, acetylated.

Find more compounds similar to 7-Chloro-s-triazolopyrimidine-5(1H)-one.

Sources

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