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Home >> Chemical Listing >> O >> 7-(2-Oxazolylthio)-3-(phenylmethyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine

7-(2-Oxazolylthio)-3-(phenylmethyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine
[CAS# 869853-70-3]

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Identification
Name 7-(2-Oxazolylthio)-3-(phenylmethyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine
Synonyms VAS 3947
Molecular Structure CAS # 869853-70-3, 7-(2-Oxazolylthio)-3-(phenylmethyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine, VAS 3947
Molecular Formula C14H10N6OS
Molecular Weight 310.33
CAS Registry Number 869853-70-3
SMILES N1=NN(C=2N=CN=C(SC3=NC=CO3)C12)CC=4C=CC=CC4
Properties
Solubility Practically insoluble (0.037 g/L g/L) (25 ºC), Calc.*
pKa 0.85±0.30 (Most basic 25 ºC), Calc.*
Density 1.55±0.1 g/cm3 (20 ºC 760 Torr), Calc.*
Boiling point 577.8±60.0 ºC (760 Torr), Calc.*
Flash point 303.3±32.9 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2022 ACD/Labs)
Safety Data
SDS Available
Market Analysis Reports
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