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Home > Nitro Compounds > 65141-45-9
65141-45-9 | N-[2-(nitrooxy)ethyl]nicotinamide monohydrochloride
CAS No: 65141-45-9 Catalog No: AG00F7KU MDL No:
Product Description
Catalog Number:
AG00F7KU
Chemical Name:
N-[2-(nitrooxy)ethyl]nicotinamide monohydrochloride
CAS Number:
65141-45-9
IUPAC Name:
2-(pyridine-3-carbonylamino)ethyl nitrate;hydrochloride
InChI:
InChI=1S/C8H9N3O4.ClH/c12-8(7-2-1-3-9-6-7)10-4-5-15-11(13)14;/h1-3,6H,4-5H2,(H,10,12);1H
InChI Key:
JAOVSCYJFMHGEJ-UHFFFAOYSA-N
EC Number:
265-513-6
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.036g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.635g/mol
Monoisotopic Mass:
247.036g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
97A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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