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1365272-15-6 | 1,2-Benzenediamine, 5-bromo-N2-cyclohexyl-3,4-difluoro-
CAS No: 1365272-15-6 Catalog No: AG0011ZJ MDL No:MFCD21609499
Product Description
Catalog Number:
AG0011ZJ
Chemical Name:
1,2-Benzenediamine, 5-bromo-N2-cyclohexyl-3,4-difluoro-
CAS Number:
1365272-15-6
Molecular Formula:
C12H15BrF2N2
Molecular Weight:
305.1617
MDL Number:
MFCD21609499
IUPAC Name:
5-bromo-2-N-cyclohexyl-3,4-difluorobenzene-1,2-diamine
InChI:
InChI=1S/C12H15BrF2N2/c13-8-6-9(16)12(11(15)10(8)14)17-7-4-2-1-3-5-7/h6-7,17H,1-5,16H2
InChI Key:
BYCNCIKBGAAWMK-UHFFFAOYSA-N
SMILES:
Nc1cc(Br)c(c(c1NC1CCCCC1)F)F
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.039g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
305.167g/mol
Monoisotopic Mass:
304.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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