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Home > Imidazoles > 70028-95-4
70028-95-4 | 2-methyl-5-nitro-1H-imidazole-1-propanol monohydrochloride
CAS No: 70028-95-4 Catalog No: AG00FDNE MDL No:
Product Description
Catalog Number:
AG00FDNE
Chemical Name:
2-methyl-5-nitro-1H-imidazole-1-propanol monohydrochloride
CAS Number:
70028-95-4
IUPAC Name:
3-(2-methyl-5-nitroimidazol-1-yl)propan-1-ol;hydrochloride
InChI:
InChI=1S/C7H11N3O3.ClH/c1-6-8-5-7(10(12)13)9(6)3-2-4-11;/h5,11H,2-4H2,1H3;1H
InChI Key:
PTXLKVODAFRGDG-UHFFFAOYSA-N
EC Number:
274-285-7
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.057g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.641g/mol
Monoisotopic Mass:
221.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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