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850349-28-9 | Acetic acid,2-(3-bromophenoxy)-2,2-difluoro-, ethyl ester
CAS No: 850349-28-9 Catalog No: AG004ZVD MDL No:MFCD06657736
Product Description
Catalog Number:
AG004ZVD
Chemical Name:
Acetic acid,2-(3-bromophenoxy)-2,2-difluoro-, ethyl ester
CAS Number:
850349-28-9
Molecular Formula:
C10H9BrF2O3
Molecular Weight:
295.0775
MDL Number:
MFCD06657736
IUPAC Name:
ethyl 2-(3-bromophenoxy)-2,2-difluoroacetate
InChI:
InChI=1S/C10H9BrF2O3/c1-2-15-9(14)10(12,13)16-8-5-3-4-7(11)6-8/h3-6H,2H2,1H3
InChI Key:
OYUUSOPGUZLOTL-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Oc1cccc(c1)Br)(F)F
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.97g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.08g/mol
Monoisotopic Mass:
293.97g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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