Chemical Properties of 2,4(1H,3H)-Pyrimidinedione, 6-phenyl- (CAS 13345-09-0)

2,4(1H,3H)-Pyrimidinedione, 6-phenyl-

InChI
InChI=1S/C10H8N2O2/c13-9-6-8(11-10(14)12-9)7-4-2-1-3-5-7/h1-6H,(H2,11,12,13,14)
InChI Key
NCSMAVULYUCSMB-UHFFFAOYSA-N
Formula
C10H8N2O2
SMILES
O=c1cc(-c2ccccc2)[nH]c(=O)[nH]1
Molecular Weight1
188.18
CAS
13345-09-0
Other Names
  • 6-Phenyl-2,4(1H,3H)-pyrimidinedione
  • 6-Phenyluracil
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Physical Properties

Property Value Unit Source
ω 0.5826 Relay (1.0) Calculated Property
ΔcH°solid [-4748.40; -4748.40] kJ/mol Show Hide
ΔcH°solid -4748.40 kJ/mol NIST
ΔcH°solid -4748.40 kJ/mol NIST
ΔfG° 52.18 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -149.18 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 123.36 kJ/mol Relay (1.0) Calculated Property
IE 8.50 eV Relay (1.0) Calculated Property
log10WS -2.47 Relay (1.0) Calculated Property
logPoct/wat -0.234 Crippen Calculated Property
McVol 135.940 ml/mol McGowan Calculated Property
Pc 4928.19 kPa Relay (1.0-beta) Calculated Property
Tboil 633.69 K Relay (1.0) Calculated Property
Tc 922.92 K Relay (1.0) Calculated Property
Tfus 519.80 K Relay (1.0) Calculated Property
Vc 0.492 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Zaleplon. 1H-Pyrazolo[4,3-d]pyrimidine, 7-amino-3-«beta»-D-ribofuranosyl-. Edulisin III. (1R,4S,5S)-4-tert-Butyldimethylsilyloxy-2-aza-8-oxabicyclo[3,2,1]octane. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, diacetate. 2(1H)-Pyrimidinone, 1-[2,3-bis-O-(trimethylsilyl)-«beta»-D-ribofuranosyl]-4-(trimethylsiloxy)-, 5'-[bis(trimethylsilyl) phosphate]. 5-Hydroxyuracil riboside, TMS. 4H,6h-m-dioxino[4',5':5,6]pyrano[4,3-d]-4-oxazolin-2-one, hexahydro-4-methoxy-1,8-diphenyl-. Biotin, N,N'-tert-butyldimethylsilyl-, tert-butyldimethylsilyl ester. Uridine, 2',3'-bis-O-acetyl, 5'-O-TBDMS. Ibogaine. Cytosine arabinoside, dimethyl-allyldimethylsilyl derivative. Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. cis-1,2-Tetralinediol, ferrocenylboronate.

Find more compounds similar to 2,4(1H,3H)-Pyrimidinedione, 6-phenyl-.

Sources

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