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Home > Fluorides > 1443334-89-1
1443334-89-1 | O1-[2-(3,4-Difluorophenyl)ethyl] O2-ethyl oxalate
CAS No: 1443334-89-1 Catalog No: AG01F9BN MDL No:
Product Description
Catalog Number:
AG01F9BN
Chemical Name:
O1-[2-(3,4-Difluorophenyl)ethyl] O2-ethyl oxalate
CAS Number:
1443334-89-1
Molecular Formula:
C12H12F2O4
Molecular Weight:
258.2181
IUPAC Name:
2-O-[2-(3,4-difluorophenyl)ethyl] 1-O-ethyl oxalate
InChI:
InChI=1S/C12H12F2O4/c1-2-17-11(15)12(16)18-6-5-8-3-4-9(13)10(14)7-8/h3-4,7H,2,5-6H2,1H3
InChI Key:
MYEDJIGTPWAMER-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)OCCc1ccc(c(c1)F)F
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.07g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.221g/mol
Monoisotopic Mass:
258.07g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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