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27389-57-7 | N,N,N-Trimethyl-3-(trifluoromethyl)benzenaminium iodide
CAS No: 27389-57-7 Catalog No: AG003IB4 MDL No:MFCD00059980
Product Description
Catalog Number:
AG003IB4
Chemical Name:
N,N,N-Trimethyl-3-(trifluoromethyl)benzenaminium iodide
CAS Number:
27389-57-7
Molecular Formula:
C10H13F3IN
Molecular Weight:
331.1166
MDL Number:
MFCD00059980
IUPAC Name:
trimethyl-[3-(trifluoromethyl)phenyl]azanium;iodide
InChI:
InChI=1S/C10H13F3N.HI/c1-14(2,3)9-6-4-5-8(7-9)10(11,12)13;/h4-7H,1-3H3;1H/q+1;/p-1
InChI Key:
VKZIUXSJJSEBAK-UHFFFAOYSA-M
SMILES:
FC(c1cccc(c1)[N+](C)(C)C)(F)F.[I-]
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.004g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.121g/mol
Monoisotopic Mass:
331.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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