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149477-41-8 | 1-Butanaminium, N,N,N-tributyl-, (T-4)-trifluorophenylborate(1-) (1:1)
CAS No: 149477-41-8 Catalog No: AG001LPY MDL No:MFCD09953443
Product Description
Catalog Number:
AG001LPY
Chemical Name:
1-Butanaminium, N,N,N-tributyl-, (T-4)-trifluorophenylborate(1-) (1:1)
CAS Number:
149477-41-8
Molecular Formula:
C22H41BF3N
Molecular Weight:
387.3738
MDL Number:
MFCD09953443
IUPAC Name:
tetrabutylazanium;trifluoro(phenyl)boranuide
InChI:
InChI=1S/C16H36N.C6H5BF3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;8-7(9,10)6-4-2-1-3-5-6/h5-16H2,1-4H3;1-5H/q+1;-1
InChI Key:
SQRLCDKEHWULQU-UHFFFAOYSA-N
SMILES:
F[B-](c1ccccc1)(F)F.CCCC[N+](CCCC)(CCCC)CCCC
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.328g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
387.382g/mol
Monoisotopic Mass:
387.328g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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