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85983-12-6 | Carbamic acid, ethyl-, 2-(4-(3-fluorophenoxy)phenoxy)ethyl ester
CAS No: 85983-12-6 Catalog No: AG004Q4D MDL No:
Product Description
Catalog Number:
AG004Q4D
Chemical Name:
Carbamic acid, ethyl-, 2-(4-(3-fluorophenoxy)phenoxy)ethyl ester
CAS Number:
85983-12-6
Molecular Formula:
C17H18FNO4
Molecular Weight:
319.3275
IUPAC Name:
2-[4-(3-fluorophenoxy)phenoxy]ethyl N-ethylcarbamate
InChI:
InChI=1S/C17H18FNO4/c1-2-19-17(20)22-11-10-21-14-6-8-15(9-7-14)23-16-5-3-4-13(18)12-16/h3-9,12H,2,10-11H2,1H3,(H,19,20)
InChI Key:
SFSWSVHUCMJAMU-UHFFFAOYSA-N
SMILES:
CCNC(=O)OCCOc1ccc(cc1)Oc1cccc(c1)F
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.122g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.332g/mol
Monoisotopic Mass:
319.122g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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