1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propyn-1-yl)-

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Names

[ CAS No. ]:
14114-46-6

[ Name ]:
1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propyn-1-yl)-

[Synonym ]:
3,7-dimethyl-1-prop-2-ynylpurine-2,6-dione
3,7-Dimethyl-1-(prop-2-yn-1-yl)-1H-purine-2,6(3H,7H)-dione
3,7-Dimethyl-1-(2-propynyl)xanthine DMPX

Chemical & Physical Properties

[ Density]:
1.31g/cm3

[ Boiling Point ]:
443.9ºC at 760mmHg

[ Melting Point ]:
204-205ºC

[ Molecular Formula ]:
C10H10N4O2

[ Molecular Weight ]:
218.21200

[ Flash Point ]:
222.3ºC

[ Exact Mass ]:
218.08000

[ PSA ]:
61.82000

[ Vapour Pressure ]:
4.46E-08mmHg at 25°C

[ Index of Refraction ]:
1.638

MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
22-26-36

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2933990090

Synthetic Route

Precursor & DownStream

Precursor

  • Theobromine
  • 3-Bromopropyne

DownStream

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Related Compounds

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  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
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