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87282-24-4 | 1,1-Ethanediol, 2,2,2-trifluoro-1-[3-(trifluoromethyl)-3H-diazirin-3-yl]-
CAS No: 87282-24-4 Catalog No: AG004PEH MDL No:
Product Description
Catalog Number:
AG004PEH
Chemical Name:
1,1-Ethanediol, 2,2,2-trifluoro-1-[3-(trifluoromethyl)-3H-diazirin-3-yl]-
CAS Number:
87282-24-4
Molecular Formula:
C4H2F6N2O2
Molecular Weight:
224.0613
IUPAC Name:
2,2,2-trifluoro-1-[3-(trifluoromethyl)diazirin-3-yl]ethane-1,1-diol
InChI:
InChI=1S/C4H2F6N2O2/c5-3(6,7)1(11-12-1)2(13,14)4(8,9)10/h13-14H
InChI Key:
FLGLZLBGJMMSCP-UHFFFAOYSA-N
SMILES:
FC(C1(N=N1)C(C(F)(F)F)(O)O)(F)F
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.002g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.062g/mol
Monoisotopic Mass:
224.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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