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74550-88-2 | 2-Propenoic acid, 3-(1-methyl-5-nitro-1H-imidazol-2-yl)-2-phenoxy-
CAS No: 74550-88-2 Catalog No: AG00FWVN MDL No:
Product Description
Catalog Number:
AG00FWVN
Chemical Name:
2-Propenoic acid, 3-(1-methyl-5-nitro-1H-imidazol-2-yl)-2-phenoxy-
CAS Number:
74550-88-2
IUPAC Name:
(Z)-3-(1-methyl-5-nitroimidazol-2-yl)-2-phenoxyprop-2-enoic acid
InChI:
InChI=1S/C13H11N3O5/c1-15-11(14-8-12(15)16(19)20)7-10(13(17)18)21-9-5-3-2-4-6-9/h2-8H,1H3,(H,17,18)/b10-7-
InChI Key:
SZFKMKKCZHBKOU-YFHOEESVSA-N
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
289.07g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.247g/mol
Monoisotopic Mass:
289.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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