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1099624-30-2 | Ethyl 3-(3-fluoro-phenoxy)propanoate
CAS No: 1099624-30-2 Catalog No: AG01FDB5 MDL No:
Product Description
Catalog Number:
AG01FDB5
Chemical Name:
Ethyl 3-(3-fluoro-phenoxy)propanoate
CAS Number:
1099624-30-2
Molecular Formula:
C11H13FO3
Molecular Weight:
212.2175
IUPAC Name:
ethyl 3-(3-fluorophenoxy)propanoate
InChI:
InChI=1S/C11H13FO3/c1-2-14-11(13)6-7-15-10-5-3-4-9(12)8-10/h3-5,8H,2,6-7H2,1H3
InChI Key:
YQHWNNZUNOKECV-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCOc1cccc(c1)F
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.22g/mol
Monoisotopic Mass:
212.085g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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