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245-44-3 | Pyrazino[1,2-a]indole
CAS No: 245-44-3 Catalog No: AG002OCB MDL No:
Product Description
Catalog Number:
AG002OCB
Chemical Name:
Pyrazino[1,2-a]indole
CAS Number:
245-44-3
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
IUPAC Name:
pyrazino[1,2-a]indole
InChI:
InChI=1S/C11H8N2/c1-2-4-11-9(3-1)7-10-8-12-5-6-13(10)11/h1-8H
InChI Key:
GCZDLZHMAMLSJF-UHFFFAOYSA-N
SMILES:
n1ccn2c(c1)cc1c2cccc1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Intramolecular cyclization of delta-iminoacetylenes: a new entry to pyrazino[1,2-a]indoles. | The Journal of organic chemistry 20050513 |
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