Chemical Properties of 4(1H)-Pyrimidinone, 6-amino-2,3-dihydro-2-thioxo- (CAS 1004-40-6)

4(1H)-Pyrimidinone, 6-amino-2,3-dihydro-2-thioxo-

InChI
InChI=1S/C4H5N3OS/c5-2-1-3(8)7-4(9)6-2/h1H,(H4,5,6,7,8,9)
InChI Key
YFYYRKDBDBILSD-UHFFFAOYSA-N
Formula
C4H5N3OS
SMILES
Nc1cc(=O)[nH]c(=S)[nH]1
Molecular Weight1
143.17
CAS
1004-40-6
Other Names
  • AB 48
  • Uracil, 6-amino-2-thio-
  • 2-Mercapto-6-aminouracil
  • 2-Thio-6-aminouracil
  • 4-Amino-2-thiouracil
  • 6-Amino-2-thiouracil
  • 6-Amino-4-keto-2-thiopyrimidine
  • 6-Aminothiouracil
  • NSC 1587
  • NSC 202018
  • 6-amino-2-thiouracil hydrate
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Physical Properties

Property Value Unit Source
ω 0.5691 Relay (1.0) Calculated Property
ΔfG° 72.16 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -65.14 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 134.98 kJ/mol Relay (1.0) Calculated Property
IE 7.74 eV Relay (1.0) Calculated Property
log10WS -2.11 Relay (1.0) Calculated Property
logPoct/wat -0.949 Crippen Calculated Property
McVol 95.620 ml/mol McGowan Calculated Property
Pc 5829.83 kPa Relay (1.0-beta) Calculated Property
Tboil 610.52 K Relay (1.0) Calculated Property
Tc 904.16 K Relay (1.0) Calculated Property
Tfus 540.51 K Relay (1.0) Calculated Property
Vc 0.308 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

4-Amino-2,6-dihydroxypyrimidine. 2(1H)-Pyrimidinethione, 4,6-diamino-. 2,6-Diamino-4-oxo-1,3,3a,7-tetrazaindene mono-hydrochloride. 7-Amino-S-triazolo(1,5-a)pyrimidin-5(4H)-one. 2,4(1H,3H)-Pyrimidinedione, 6-amino-1-methyl-. 1,2,3,5,6,7,8,9-Octahydro-3a,10-diaza-cyclohepta[f]inden-4-one. Rhodium-1,3,5,7-tetramethyl-2,4,6,8-tetraethylporphyrine complex, OAc. 3H-Pyrimidin-4-one, 2,3-trimethyleno-5,6-tetramethyleno-6-methyl. 2,3,5,6,7,8,9,10-Octahydro-1H-cycloocta[d]pyrrolo[1,2-a]pyrimidin-11-one. 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. thymidine, TMS. Thymine deoxyriboside, TMS. 11H-Pyrido[2,1-b]quinazolin-11-one, 1,2,3,4,6,7,8,9-octahydro, 9-methyl. Vomifolyl «beta»-D-glucopyranoside, TFA.

Find more compounds similar to 4(1H)-Pyrimidinone, 6-amino-2,3-dihydro-2-thioxo-.

Sources

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