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1381762-52-2 | 5-Bromo-4-(heptafluoropropyl)-1,3-thiazol-2-amine
CAS No: 1381762-52-2 Catalog No: AG01F9AE MDL No:
Product Description
Catalog Number:
AG01F9AE
Chemical Name:
5-Bromo-4-(heptafluoropropyl)-1,3-thiazol-2-amine
CAS Number:
1381762-52-2
Molecular Formula:
C6H2BrF7N2S
Molecular Weight:
347.0513
IUPAC Name:
5-bromo-4-(1,1,2,2,3,3,3-heptafluoropropyl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C6H2BrF7N2S/c7-2-1(16-3(15)17-2)4(8,9)5(10,11)6(12,13)14/h(H2,15,16)
InChI Key:
RCKRKAZXYSPWHO-UHFFFAOYSA-N
SMILES:
FC(C(C(F)(F)F)(F)F)(c1nc(sc1Br)N)F
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.901g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.049g/mol
Monoisotopic Mass:
345.901g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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