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Home > Fluorides > 141332-96-9
141332-96-9 | Ethanediamide, N1-[2-[3,4-bis(difluoromethoxy)phenyl]ethyl]-
CAS No: 141332-96-9 Catalog No: AG001G8D MDL No:
Product Description
Catalog Number:
AG001G8D
Chemical Name:
Ethanediamide, N1-[2-[3,4-bis(difluoromethoxy)phenyl]ethyl]-
CAS Number:
141332-96-9
Molecular Formula:
C12H12F4N2O4
Molecular Weight:
324.2283
IUPAC Name:
N'-[2-[3,4-bis(difluoromethoxy)phenyl]ethyl]oxamide
InChI:
InChI=1S/C12H12F4N2O4/c13-11(14)21-7-2-1-6(5-8(7)22-12(15)16)3-4-18-10(20)9(17)19/h1-2,5,11-12H,3-4H2,(H2,17,19)(H,18,20)
InChI Key:
MSMOZSVBEHEDPB-UHFFFAOYSA-N
SMILES:
FC(Oc1cc(CCNC(=O)C(=O)N)ccc1OC(F)F)F
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.073g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
324.232g/mol
Monoisotopic Mass:
324.073g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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