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Home > Indoles and Oxindole > 96838-93-6
96838-93-6 | 3-Indolizinecarbonitrile, octahydro-5-propyl-
CAS No: 96838-93-6 Catalog No: AG006662 MDL No:
Product Description
Catalog Number:
AG006662
Chemical Name:
3-Indolizinecarbonitrile, octahydro-5-propyl-
CAS Number:
96838-93-6
Molecular Formula:
C12H20N2
Molecular Weight:
192.3006
IUPAC Name:
5-propyl-1,2,3,5,6,7,8,8a-octahydroindolizine-3-carbonitrile
InChI:
InChI=1S/C12H20N2/c1-2-4-10-5-3-6-11-7-8-12(9-13)14(10)11/h10-12H,2-8H2,1H3
InChI Key:
CFFLJMIWAWBLSD-UHFFFAOYSA-N
SMILES:
CCCC1CCCC2N1C(C#N)CC2
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.163g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.306g/mol
Monoisotopic Mass:
192.163g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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