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111934-95-3

111934-95-3 | Ethyl 2,2-Difluorooctanoate

CAS No: 111934-95-3 Catalog No: AG01FFCQ MDL No:MFCD15530337

Product Description

Catalog Number:
AG01FFCQ
Chemical Name:
Ethyl 2,2-Difluorooctanoate
CAS Number:
111934-95-3
Molecular Formula:
C10H18F2O2
Molecular Weight:
208.2455
MDL Number:
MFCD15530337
IUPAC Name:
ethyl 2,2-difluorooctanoate
InChI:
InChI=1S/C10H18F2O2/c1-3-5-6-7-8-10(11,12)9(13)14-4-2/h3-8H2,1-2H3
InChI Key:
WHNDVBKXJCHZAY-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(=O)OCC)(F)F

Properties

Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.127g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.249g/mol
Monoisotopic Mass:
208.127g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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