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Home > Imidazoles > 83898-63-9
83898-63-9 | Imidazo[1,5-a]pyrazin-1(5H)-one,hexahydro-3,3-dimethyl-
CAS No: 83898-63-9 Catalog No: AG008HPO MDL No:
Product Description
Catalog Number:
AG008HPO
Chemical Name:
Imidazo[1,5-a]pyrazin-1(5H)-one,hexahydro-3,3-dimethyl-
CAS Number:
83898-63-9
Molecular Formula:
C8H15N3O
Molecular Weight:
169.2242
IUPAC Name:
3,3-dimethyl-2,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyrazin-1-one
InChI:
InChI=1S/C8H15N3O/c1-8(2)10-7(12)6-5-9-3-4-11(6)8/h6,9H,3-5H2,1-2H3,(H,10,12)
InChI Key:
IEYKCXJYWXSHCR-UHFFFAOYSA-N
SMILES:
O=C1NC(N2C1CNCC2)(C)C
EC Number:
281-275-6
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.122g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.228g/mol
Monoisotopic Mass:
169.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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