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1432030-55-1 | methyl({[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl})amine hydrochloride
CAS No: 1432030-55-1 Catalog No: AG01FK6S MDL No:
Product Description
Catalog Number:
AG01FK6S
Chemical Name:
methyl({[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl})amine hydrochloride
CAS Number:
1432030-55-1
Molecular Formula:
C7H11ClF3N3
Molecular Weight:
229.6305
IUPAC Name:
N-methyl-1-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]methanamine;hydrochloride
InChI:
InChI=1S/C7H10F3N3.ClH/c1-11-4-5-3-6(7(8,9)10)12-13(5)2;/h3,11H,4H2,1-2H3;1H
InChI Key:
BXQAMCBQQLEINB-UHFFFAOYSA-N
SMILES:
CNCc1cc(nn1C)C(F)(F)F.Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.631g/mol
Monoisotopic Mass:
229.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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