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Home > Fluorides > 1171938-74-1
1171938-74-1 | 2H-Tetrazole, 5-(2-fluoro-5-nitrophenyl)-
CAS No: 1171938-74-1 Catalog No: AG000DWN MDL No:MFCD18375288
Product Description
Catalog Number:
AG000DWN
Chemical Name:
2H-Tetrazole, 5-(2-fluoro-5-nitrophenyl)-
CAS Number:
1171938-74-1
Molecular Formula:
C7H4FN5O2
Molecular Weight:
209.1374
MDL Number:
MFCD18375288
IUPAC Name:
5-(2-fluoro-5-nitrophenyl)-2H-tetrazole
InChI:
InChI=1S/C7H4FN5O2/c8-6-2-1-4(13(14)15)3-5(6)7-9-11-12-10-7/h1-3H,(H,9,10,11,12)
InChI Key:
FPUYMBWDUWZGHY-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1c1n[nH]nn1)[N+](=O)[O-]
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.035g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.14g/mol
Monoisotopic Mass:
209.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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