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Home > Imidazoles > 67139-25-7
67139-25-7 | 5H,6H,7H,8H,9H-Imidazo[1,2-a][1,3]diazepine
CAS No: 67139-25-7 Catalog No: AG01EWUT MDL No:
Product Description
Catalog Number:
AG01EWUT
Chemical Name:
5H,6H,7H,8H,9H-Imidazo[1,2-a][1,3]diazepine
CAS Number:
67139-25-7
Molecular Formula:
C7H11N3
Molecular Weight:
137.1823
IUPAC Name:
6,7,8,9-tetrahydro-5H-imidazo[1,2-a][1,3]diazepine
InChI:
InChI=1S/C7H11N3/c1-2-5-10-6-4-9-7(10)8-3-1/h4,6H,1-3,5H2,(H,8,9)
InChI Key:
RLFGJOGAZDXJFO-UHFFFAOYSA-N
SMILES:
C1CNc2n(CC1)ccn2
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.186g/mol
Monoisotopic Mass:
137.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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