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21132-30-9 | Urea, N,N'-bis(2,3,4,5,6-pentafluorophenyl)-
CAS No: 21132-30-9 Catalog No: AG002LAP MDL No:MFCD00015445
Product Description
Catalog Number:
AG002LAP
Chemical Name:
Urea, N,N'-bis(2,3,4,5,6-pentafluorophenyl)-
CAS Number:
21132-30-9
Molecular Formula:
C13H2F10N2O
Molecular Weight:
392.1518
MDL Number:
MFCD00015445
IUPAC Name:
1,3-bis(2,3,4,5,6-pentafluorophenyl)urea
InChI:
InChI=1S/C13H2F10N2O/c14-1-3(16)7(20)11(8(21)4(1)17)24-13(26)25-12-9(22)5(18)2(15)6(19)10(12)23/h(H2,24,25,26)
InChI Key:
JXOIMJFRROBTTE-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(F)c(F)c(c(c1F)F)F)Nc1c(F)c(F)c(c(c1F)F)F
EC Number:
244-231-7
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.001g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
392.156g/mol
Monoisotopic Mass:
392.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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