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1949815-78-4 | 5-((methylamino)methyl)pyridin-2(1H)-one dihydrobromide
CAS No: 1949815-78-4 Catalog No: AG01FMRO MDL No:MFCD30011202
Product Description
Catalog Number:
AG01FMRO
Chemical Name:
5-((methylamino)methyl)pyridin-2(1H)-one dihydrobromide
CAS Number:
1949815-78-4
Molecular Formula:
C7H12Br2N2O
Molecular Weight:
299.9910
MDL Number:
MFCD30011202
IUPAC Name:
5-(methylaminomethyl)-1H-pyridin-2-one;dihydrobromide
InChI:
InChI=1S/C7H10N2O.2BrH/c1-8-4-6-2-3-7(10)9-5-6;;/h2-3,5,8H,4H2,1H3,(H,9,10);2*1H
InChI Key:
YYTCSJXGUWWSSJ-UHFFFAOYSA-N
SMILES:
CNCc1ccc(=O)[nH]c1.Br.Br
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.93g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
299.994g/mol
Monoisotopic Mass:
297.932g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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