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304694-40-4 | 1,2-Ethanediamine, N1,N1-diethyl-N2-[[4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]methyl]-
CAS No: 304694-40-4 Catalog No: AG00308K MDL No:
Product Description
Catalog Number:
AG00308K
Chemical Name:
1,2-Ethanediamine, N1,N1-diethyl-N2-[[4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]methyl]-
CAS Number:
304694-40-4
Molecular Formula:
C20H25F3N2
Molecular Weight:
350.4211
IUPAC Name:
N',N'-diethyl-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethane-1,2-diamine
InChI:
InChI=1S/C20H25F3N2/c1-3-25(4-2)14-13-24-15-16-5-7-17(8-6-16)18-9-11-19(12-10-18)20(21,22)23/h5-12,24H,3-4,13-15H2,1-2H3
InChI Key:
CQBYREFQWDUSJY-UHFFFAOYSA-N
SMILES:
CCN(CCNCc1ccc(cc1)c1ccc(cc1)C(F)(F)F)CC
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.197g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.429g/mol
Monoisotopic Mass:
350.197g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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