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Home > Fluorides > 114467-89-9
114467-89-9 | Benzene, (azidodifluoromethyl)-
CAS No: 114467-89-9 Catalog No: AG000EGJ MDL No:MFCD24453738
Product Description
Catalog Number:
AG000EGJ
Chemical Name:
Benzene, (azidodifluoromethyl)-
CAS Number:
114467-89-9
Molecular Formula:
C7H5F2N3
Molecular Weight:
169.1315
MDL Number:
MFCD24453738
IUPAC Name:
[azido(difluoro)methyl]benzene
InChI:
InChI=1S/C7H5F2N3/c8-7(9,11-12-10)6-4-2-1-3-5-6/h1-5H
InChI Key:
VNFUAQVUHARBBN-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1)(N=[N+]=[N-])F
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.045g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.135g/mol
Monoisotopic Mass:
169.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
14.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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