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Home > Imidazoles > 708262-93-5
708262-93-5 | 1H,5H-Imidazo[1,5-c][1,3,5]oxadiazepine(9CI)
CAS No: 708262-93-5 Catalog No: AG005QST MDL No:
Product Description
Catalog Number:
AG005QST
Chemical Name:
1H,5H-Imidazo[1,5-c][1,3,5]oxadiazepine(9CI)
CAS Number:
708262-93-5
Molecular Formula:
C6H7N3O
Molecular Weight:
137.1393
IUPAC Name:
1,5-dihydroimidazo[1,5-c][1,3,5]oxadiazepine
InChI:
InChI=1S/C6H7N3O/c1-2-10-5-9-4-7-3-6(9)8-1/h1-4,8H,5H2
InChI Key:
UGYJVEGWJWHHGR-UHFFFAOYSA-N
SMILES:
C1=CNc2n(CO1)cnc2
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.142g/mol
Monoisotopic Mass:
137.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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