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Home Other Building Blocks 1-N-[5-(trifluoromethyl)pyridin-2-yl]benzene-1,4-diamine dihydrochloride

1-N-[5-(trifluoromethyl)pyridin-2-yl]benzene-1,4-diamine dihydrochloride

CAS No.:
1354950-89-2
Catalog Number:
AG01AKWR
Molecular Formula:
C12H12Cl2F3N3
Molecular Weight:
326.1450
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Product Description
Catalog Number:
AG01AKWR
Chemical Name:
1-N-[5-(trifluoromethyl)pyridin-2-yl]benzene-1,4-diamine dihydrochloride
CAS Number:
1354950-89-2
Molecular Formula:
C12H12Cl2F3N3
Molecular Weight:
326.1450
MDL Number:
MFCD20233618
IUPAC Name:
4-N-[5-(trifluoromethyl)pyridin-2-yl]benzene-1,4-diamine;dihydrochloride
InChI:
InChI=1S/C12H10F3N3.2ClH/c13-12(14,15)8-1-6-11(17-7-8)18-10-4-2-9(16)3-5-10;;/h1-7H,16H2,(H,17,18);2*1H
InChI Key:
AIVMVGKTUICNOT-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)Nc1ccc(cn1)C(F)(F)F.Cl.Cl
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.036g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
326.144g/mol
Monoisotopic Mass:
325.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties