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680-65-9 | Diethyl 2,2-difluoromalonate
CAS No: 680-65-9 Catalog No: AG0036T8 MDL No:MFCD00221617
Product Description
Catalog Number:
AG0036T8
Chemical Name:
Diethyl 2,2-difluoromalonate
CAS Number:
680-65-9
Molecular Formula:
C7H10F2O4
Molecular Weight:
196.1487
MDL Number:
MFCD00221617
IUPAC Name:
diethyl 2,2-difluoropropanedioate
InChI:
InChI=1S/C7H10F2O4/c1-3-12-5(10)7(8,9)6(11)13-4-2/h3-4H2,1-2H3
InChI Key:
WCRVWLHTROHXBB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)(F)F
NSC Number:
92219
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.15g/mol
Monoisotopic Mass:
196.055g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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