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833451-99-3 | Benzenamine, 6-ethenyl-2,3-difluoro-N-(2-fluoro-4-iodophenyl)-
CAS No: 833451-99-3 Catalog No: AG004X8S MDL No:
Product Description
Catalog Number:
AG004X8S
Chemical Name:
Benzenamine, 6-ethenyl-2,3-difluoro-N-(2-fluoro-4-iodophenyl)-
CAS Number:
833451-99-3
Molecular Formula:
C14H9F3IN
Molecular Weight:
375.1276
IUPAC Name:
6-ethenyl-2,3-difluoro-N-(2-fluoro-4-iodophenyl)aniline
InChI:
InChI=1S/C14H9F3IN/c1-2-8-3-5-10(15)13(17)14(8)19-12-6-4-9(18)7-11(12)16/h2-7,19H,1H2
InChI Key:
TWSFWYQNKRZGFW-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(c(c1Nc1ccc(cc1F)I)F)F
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.973g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
375.133g/mol
Monoisotopic Mass:
374.973g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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