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Home > Imidazoles > 111547-87-6
111547-87-6 | 2-ETHYLIMIDAZOLINE
CAS No: 111547-87-6 Catalog No: AG007SP4 MDL No:
Product Description
Catalog Number:
AG007SP4
Chemical Name:
2-ETHYLIMIDAZOLINE
CAS Number:
111547-87-6
Molecular Formula:
C5H10N2
Molecular Weight:
98.1463
IUPAC Name:
2-ethyl-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C5H10N2/c1-2-5-6-3-4-7-5/h2-4H2,1H3,(H,6,7)
InChI Key:
QUPKCFBHJFNUEW-UHFFFAOYSA-N
SMILES:
CCC1=NCCN1
Properties
Complexity:
86.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.084g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
98.149g/mol
Monoisotopic Mass:
98.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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