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1432029-26-9 | [4-(2-methyl-1H-imidazol-1-yl)phenyl]methanamine dihydrochloride
CAS No: 1432029-26-9 Catalog No: AG01FKA4 MDL No:
Product Description
Catalog Number:
AG01FKA4
Chemical Name:
[4-(2-methyl-1H-imidazol-1-yl)phenyl]methanamine dihydrochloride
CAS Number:
1432029-26-9
Molecular Formula:
C11H15Cl2N3
Molecular Weight:
260.1629
IUPAC Name:
[4-(2-methylimidazol-1-yl)phenyl]methanamine;dihydrochloride
InChI:
InChI=1S/C11H13N3.2ClH/c1-9-13-6-7-14(9)11-4-2-10(8-12)3-5-11;;/h2-7H,8,12H2,1H3;2*1H
InChI Key:
YSIDNQKGUSKSHW-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)n1ccnc1C.Cl.Cl
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.064g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
260.162g/mol
Monoisotopic Mass:
259.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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