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56468-21-4 | 7H,8H-imidazo[1,5-a]pyrazin-8-one
CAS No: 56468-21-4 Catalog No: AG01BVMS MDL No:MFCD19221408
Product Description
Catalog Number:
AG01BVMS
Chemical Name:
7H,8H-imidazo[1,5-a]pyrazin-8-one
CAS Number:
56468-21-4
Molecular Formula:
C6H5N3O
Molecular Weight:
135.1234
MDL Number:
MFCD19221408
IUPAC Name:
7H-imidazo[1,5-a]pyrazin-8-one
InChI:
InChI=1S/C6H5N3O/c10-6-5-3-7-4-9(5)2-1-8-6/h1-4H,(H,8,10)
InChI Key:
SLYRIXNICMCXFH-UHFFFAOYSA-N
SMILES:
O=c1[nH]ccn2c1cnc2
NSC Number:
209767
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.043g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.126g/mol
Monoisotopic Mass:
135.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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