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686295-96-5 | 1,6-ETHANO-2H-QUINOLIZINE
CAS No: 686295-96-5 Catalog No: AG0062KE MDL No:
Product Description
Catalog Number:
AG0062KE
Chemical Name:
1,6-ETHANO-2H-QUINOLIZINE
CAS Number:
686295-96-5
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
IUPAC Name:
8-azatricyclo[6.4.0.04,9]dodeca-1(12),4(9),6,10-tetraene
InChI:
InChI=1S/C11H11N/c1-4-10-7-6-9-3-2-8-12(10)11(9)5-1/h1-2,4-5,8H,3,6-7H2
InChI Key:
PGJBXCUWGMHYLJ-UHFFFAOYSA-N
SMILES:
c1cc2CCC3=c(c1)n2C=CC3
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.216g/mol
Monoisotopic Mass:
157.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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