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{Error}
Predict NMR spectrum
RN: 
51-17-2
MF:  {Error}
MW: 
118.13804
bp (°C): 
360
mp (°C): 
171  - 174
InChI:  1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9)
InChIKey:  HYZJCKYKOHLVJF-UHFFFAOYSA-N
H donor:  1
H acceptor:  2
Rotatable bond:  0
Stereocenter:  0
cLogP:  1.62
cLogS:  -1.827
Polar surface:  28.68
NEW: 3D model: 
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  Supplier     Description     Reference  
amadischem {error}, {error}
Bulk, semi-bulk
advtechind {error}, {error}
1KG
leapchem {error}, {error}
on request
leapchem {error}, {error}
on request
leapchem {error}, {error}
on request
alfa-chemistry {error}, {error}
aifchem {error}, {error}
{Error}
alfa-chemistry {error}, {error}
{Error}
cm-finechemicals {error}, {error}
{Error}
bocsci {error}, {error}
on request
advtechind {error}, {error}
advtechind {error}, {error}
250G
carbonesci {error}, {error}
on request
lingruichem {error}, {error}
on request
oakwood {error}, {error}
{Error}
chemtour {error}, {error}
on request
rovathin {error}, {error}
on request
aboundchem {error}, {error}
{Error}
sagechem {error}, {error}
on request
biosynth {error}, {error}
on request

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