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Caffeine
Predict NMR spectrum
RN: 
58-08-2
MF: 
C8H10N4O2
MW: 
194.193
mp (°C): 
234  - 239
density: 
1.23
InChI:  1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
InChIKey:  RYYVLZVUVIJVGH-UHFFFAOYSA-N
H donor:  0
H acceptor:  6
Rotatable bond:  0
Stereocenter:  0
cLogP:  -0.23
cLogS:  -1.144
Polar surface:  58.44
NEW: 3D model: 
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  Supplier     Description     Reference  
advtechind kola nut ext 10% caffeine
on request
INQUIRY
advtechind caffeine
on request
100G
advtechind caffeine imp. C (ep): 1,3,9-trimethyl-3,9-dihydro-1H-purine-2,6-dione (isocaffeine)
on request
50 MG
advtechind caffeine, bp standard
on request
100MG
advtechind caffeine imp. E (ep) as nitrate: N,1-dimethyl-4-(methylamino)-1H-imidazole-5-carbox-amide nitrate (caffeidine nitrate)
on request
100 MG
advtechind caffeine, for system suitability
on request
20MG
capotchem
3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
1g
5g
10g
25g
cm-finechemicals Caffeine
Research
Pilot
chemieliva Caffeine, 98%
5G
10G
20G
50G
100G
50KG
oakwood
1,3,7-Trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
250mg
1g
5g
25g
rosewachem Caffeine
on request
advtechind caffeine, ep standard
on request
70MG
advtechind caffeine, 60% from green tea
on request
INQUIRY
advtechind caffeine, bp/usp/cp
1KG
chempur Caffeine/ 99.0 - 101.0 % (dried basis)
100 g
and other units
advtechind caffeine, 22% from guarana seed (blending)
on request
INQUIRY
advtechind caffeine, 20% from green tea
on request
INQUIRY
advtechind caffeine, 10% from coco nut
on request
INQUIRY
advtechind caffeine, 50% from green tea
on request
INQUIRY
advtechind caffeine, 12% from coco nut
on request
INQUIRY

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