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Home > Fluorides > 823189-08-8
823189-08-8 | Benzene, 1-(2-azidoethyl)-3,5-bis(trifluoromethyl)-
CAS No: 823189-08-8 Catalog No: AG00552G MDL No:
Product Description
Catalog Number:
AG00552G
Chemical Name:
Benzene, 1-(2-azidoethyl)-3,5-bis(trifluoromethyl)-
CAS Number:
823189-08-8
Molecular Formula:
C10H7F6N3
Molecular Weight:
283.1731
IUPAC Name:
1-(2-azidoethyl)-3,5-bis(trifluoromethyl)benzene
InChI:
InChI=1S/C10H7F6N3/c11-9(12,13)7-3-6(1-2-18-19-17)4-8(5-7)10(14,15)16/h3-5H,1-2H2
InChI Key:
LURXFJOLHJYSLQ-UHFFFAOYSA-N
SMILES:
FC(c1cc(CCN=[N+]=[N-])cc(c1)C(F)(F)F)(F)F
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.054g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.177g/mol
Monoisotopic Mass:
283.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
14.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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