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1196155-82-4 | 5-Pyrimidineethanamine, 2-methoxy-, hydrochloride (1:1)
CAS No: 1196155-82-4 Catalog No: AG000PD1 MDL No:
Product Description
Catalog Number:
AG000PD1
Chemical Name:
5-Pyrimidineethanamine, 2-methoxy-, hydrochloride (1:1)
CAS Number:
1196155-82-4
Molecular Formula:
C7H12ClN3O
Molecular Weight:
189.6427
IUPAC Name:
2-(2-methoxypyrimidin-5-yl)ethylazanium;chloride
InChI:
InChI=1S/C7H11N3O.ClH/c1-11-7-9-4-6(2-3-8)5-10-7;/h4-5H,2-3,8H2,1H3;1H
InChI Key:
MBUZQUBGTIWVHG-UHFFFAOYSA-N
SMILES:
NCCc1cnc(nc1)OC.Cl
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.643g/mol
Monoisotopic Mass:
189.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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