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112565-57-8 | Pyrrolizino[1,2-b]indole, 1,2,3,3a,4,9-hexahydro-
CAS No: 112565-57-8 Catalog No: AG007SXQ MDL No:
Product Description
Catalog Number:
AG007SXQ
Chemical Name:
Pyrrolizino[1,2-b]indole, 1,2,3,3a,4,9-hexahydro-
CAS Number:
112565-57-8
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
IUPAC Name:
8,14-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6-tetraene
InChI:
InChI=1S/C13H14N2/c1-2-5-11-9(4-1)10-8-15-7-3-6-12(15)13(10)14-11/h1-2,4-5,12,14H,3,6-8H2
InChI Key:
IZEPOXAREJSTNC-UHFFFAOYSA-N
SMILES:
C1CN2C(C1)c1c(C2)c2c([nH]1)cccc2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
19A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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