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1004-40-6

Name 6-Aminothiouracil
CAS 1004-40-6
EINECS(EC#) 213-722-8
Molecular Formula C4H5N3OS
MDL Number MFCD00052384
Molecular Weight 143.17
MOL File 1004-40-6.mol

Chemical Properties

Melting point  >300?C (dec.)
Boiling point  246.5°C
density  1.397 (estimate)
refractive index  1.7490 (estimate)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  DMSO (Slightly), Methanol (Slightly)
form  crystalline solid
pka 7.92±0.20(Predicted)
color  Off-white
Water Solubility  256.3mg/L(25 ºC)
Detection Methods HPLC
InChI InChI=1S/C4H5N3OS/c5-2-1-3(8)7-4(9)6-2/h1H,(H4,5,6,7,8,9)
InChIKey YFYYRKDBDBILSD-UHFFFAOYSA-N
SMILES C1(=S)NC(N)=CC(=O)N1
CAS DataBase Reference 1004-40-6(CAS DataBase Reference)
NIST Chemistry Reference Uracil, 6-amino-2-thio-(1004-40-6)
EPA Substance Registry System 1004-40-6(EPA Substance)

Safety Data

Hazard Codes  Xi
RTECS  UW0495000
HS Code  2933599590
Toxicity
LD50 ipr-mus: 370 mg/kg ARZNAD 31,1713,81

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