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Home > Imidazoles > 114543-38-3
114543-38-3 | 5H-Pyrrolo[1,2-a]imidazol-5-one, hexahydro-7a-propyl-
CAS No: 114543-38-3 Catalog No: AG000ENH MDL No:
Product Description
Catalog Number:
AG000ENH
Chemical Name:
5H-Pyrrolo[1,2-a]imidazol-5-one, hexahydro-7a-propyl-
CAS Number:
114543-38-3
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
IUPAC Name:
7a-propyl-2,3,6,7-tetrahydro-1H-pyrrolo[1,2-a]imidazol-5-one
InChI:
InChI=1S/C9H16N2O/c1-2-4-9-5-3-8(12)11(9)7-6-10-9/h10H,2-7H2,1H3
InChI Key:
ALNAMJZTZZOVKL-UHFFFAOYSA-N
SMILES:
CCCC12NCCN2C(=O)CC1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.24g/mol
Monoisotopic Mass:
168.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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