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Home > Other Heterocycles > 155774-31-5
155774-31-5 | 7,9-Diazabicyclo[4.2.1]nonane (9CI)
CAS No: 155774-31-5 Catalog No: AG001O60 MDL No:
Product Description
Catalog Number:
AG001O60
Chemical Name:
7,9-Diazabicyclo[4.2.1]nonane (9CI)
CAS Number:
155774-31-5
Molecular Formula:
C7H14N2
Molecular Weight:
126.1995
IUPAC Name:
7,9-diazabicyclo[4.2.1]nonane
InChI:
InChI=1S/C7H14N2/c1-2-4-7-8-5-6(3-1)9-7/h6-9H,1-5H2
InChI Key:
GYQKVJKRLNRYMV-UHFFFAOYSA-N
SMILES:
C1CCC2NC(C1)NC2
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.116g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.203g/mol
Monoisotopic Mass:
126.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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