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141586-53-0 | 8,9-Diazatetracyclo[5.2.1.01,5.02,4]decane (9CI)
CAS No: 141586-53-0 Catalog No: AG001GMQ MDL No:
Product Description
Catalog Number:
AG001GMQ
Chemical Name:
8,9-Diazatetracyclo[5.2.1.01,5.02,4]decane (9CI)
CAS Number:
141586-53-0
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
IUPAC Name:
8,9-diazatetracyclo[5.2.1.01,5.02,4]decane
InChI:
InChI=1S/C8H12N2/c1-4-3-8(10-9-4)6(1)5-2-7(5)8/h4-7,9-10H,1-3H2
InChI Key:
GCULNZPFWSCKET-UHFFFAOYSA-N
SMILES:
N1NC23CC1CC2C1C3C1
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.198g/mol
Monoisotopic Mass:
136.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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