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Home > Imidazoles > 108796-99-2
108796-99-2 | 1H-Indole, 2-(4,5-dihydro-1H-imidazol-2-yl)-2,3-dihydro-1-propyl-
CAS No: 108796-99-2 Catalog No: AG008399 MDL No:
Product Description
Catalog Number:
AG008399
Chemical Name:
1H-Indole, 2-(4,5-dihydro-1H-imidazol-2-yl)-2,3-dihydro-1-propyl-
CAS Number:
108796-99-2
Molecular Formula:
C14H19N3
Molecular Weight:
229.3208
IUPAC Name:
2-(4,5-dihydro-1H-imidazol-2-yl)-1-propyl-2,3-dihydroindole
InChI:
InChI=1S/C14H19N3/c1-2-9-17-12-6-4-3-5-11(12)10-13(17)14-15-7-8-16-14/h3-6,13H,2,7-10H2,1H3,(H,15,16)
InChI Key:
ZYYGDUFRXNYWNW-UHFFFAOYSA-N
SMILES:
CCCN1C(Cc2c1cccc2)C1=NCCN1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.327g/mol
Monoisotopic Mass:
229.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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