1004-39-3

Name 4,6-DIAMINO-2-MERCAPTOPYRIMIDINE
CAS 1004-39-3
EINECS(EC#) 213-721-2
Molecular Formula C4H6N4S
MDL Number MFCD00006078
Molecular Weight 142.18
MOL File 1004-39-3.mol

Chemical Properties

Appearance Brown-Grey Solid
Melting point  >300 °C(lit.)
Boiling point  289.1±43.0 °C(Predicted)
density  1.78±0.1 g/cm3(Predicted)
storage temp.  Store below +30°C.
solubility  1 M NaOH: soluble2%
form  Solid
pka 11.81±0.10(Predicted)
color  Pale Beige to Light Brown
Usage 2-Thioadenosine derivatives have been known to exhibit several pharmacological activities such as platelet aggregation inhibition and coronary vasodilation
Detection Methods HPLC
BRN  124937
Stability: Hygroscopic
InChI 1S/C4H6N4S/c5-2-1-3(6)8-4(9)7-2/h1H,(H5,5,6,7,8,9)
InChIKey QCAWOHUJKPKOMD-UHFFFAOYSA-N
SMILES S=[c]1[nH]c(cc(n1)N)N
CAS DataBase Reference 1004-39-3(CAS DataBase Reference)
NIST Chemistry Reference 2-Thiol-4,6-diamino-pyrimidine(1004-39-3)
EPA Substance Registry System 1004-39-3(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
WGK Germany  3
RTECS  MB7660000
TSCA  TSCA listed
HS Code  2933 59 95
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2

Raw materials And Preparation Products

Hazard Information

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