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1070878-68-0 | 2-nitro-1-(prop-2-ynyl)-1H-imidazole
CAS No: 1070878-68-0 Catalog No: AG009770 MDL No:
Product Description
Catalog Number:
AG009770
Chemical Name:
2-nitro-1-(prop-2-ynyl)-1H-imidazole
CAS Number:
1070878-68-0
IUPAC Name:
2-nitro-1-prop-2-ynylimidazole
InChI:
InChI=1S/C6H5N3O2/c1-2-4-8-5-3-7-6(8)9(10)11/h1,3,5H,4H2
InChI Key:
DNHBKQXETVPSLC-UHFFFAOYSA-N
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.125g/mol
Monoisotopic Mass:
151.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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