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1198-63-6 | 1,3-Benzenediamine, 2,4,5,6-tetrafluoro-
CAS No: 1198-63-6 Catalog No: AG000POS MDL No:MFCD00039764
Product Description
Catalog Number:
AG000POS
Chemical Name:
1,3-Benzenediamine, 2,4,5,6-tetrafluoro-
CAS Number:
1198-63-6
Molecular Formula:
C6H4F4N2
Molecular Weight:
180.1030
MDL Number:
MFCD00039764
IUPAC Name:
2,4,5,6-tetrafluorobenzene-1,3-diamine
InChI:
InChI=1S/C6H4F4N2/c7-1-2(8)5(11)4(10)6(12)3(1)9/h11-12H2
InChI Key:
FXGQUGCFZKMIJW-UHFFFAOYSA-N
SMILES:
Nc1c(F)c(N)c(c(c1F)F)F
EC Number:
214-836-0
UNII:
19XX864S3H
NSC Number:
114705
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.031g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.106g/mol
Monoisotopic Mass:
180.031g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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