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367-30-6 | 2,5-Difluoroaniline
CAS No: 367-30-6 Catalog No: AG003FY8 MDL No:MFCD00007651
Product Description
Catalog Number:
AG003FY8
Chemical Name:
2,5-Difluoroaniline
CAS Number:
367-30-6
Molecular Formula:
C6H5F2N
Molecular Weight:
129.1074
MDL Number:
MFCD00007651
IUPAC Name:
2,5-difluoroaniline
InChI:
InChI=1S/C6H5F2N/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2
InChI Key:
YNOOQIUSYGWMSS-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)N)F
EC Number:
206-690-1
NSC Number:
3259
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.039g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.11g/mol
Monoisotopic Mass:
129.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| 2,4-Di-tert-butyl-6-[(2,5-difluorophenyl)iminomethyl]phenol. | Acta crystallographica. Section E, Structure reports online 20091101 |
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