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Home > Imidazoles > 149849-88-7
149849-88-7 | 1H-Imidazole, 2-[(3-azido-4-iodophenoxy)methyl]-4,5-dihydro-
CAS No: 149849-88-7 Catalog No: AG001M1N MDL No:
Product Description
Catalog Number:
AG001M1N
Chemical Name:
1H-Imidazole, 2-[(3-azido-4-iodophenoxy)methyl]-4,5-dihydro-
CAS Number:
149849-88-7
Molecular Formula:
C10H10IN5O
Molecular Weight:
343.1238
IUPAC Name:
2-azido-4-iodo-1-(phenoxymethyl)-4,5-dihydroimidazole
InChI:
InChI=1S/C10H10IN5O/c11-9-6-16(10(13-9)14-15-12)7-17-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChI Key:
AXTOVYLDSIOMJV-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1cc(OCC2=NCCN2)ccc1I
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.993g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.128g/mol
Monoisotopic Mass:
342.993g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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