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122008-78-0 | Propanoic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]-, (2R)-
CAS No: 122008-78-0 Catalog No: AG0016M2 MDL No:MFCD28015762
Product Description
Catalog Number:
AG0016M2
Chemical Name:
Propanoic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]-, (2R)-
CAS Number:
122008-78-0
Molecular Formula:
C16H12FNO4
Molecular Weight:
301.2692
MDL Number:
MFCD28015762
IUPAC Name:
(2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid
InChI:
InChI=1S/C16H12FNO4/c1-10(16(19)20)21-12-3-5-13(6-4-12)22-15-7-2-11(9-18)8-14(15)17/h2-8,10H,1H3,(H,19,20)/t10-/m1/s1
InChI Key:
ROBSGBGTWRRYSK-SNVBAGLBSA-N
SMILES:
N#Cc1ccc(c(c1)F)Oc1ccc(cc1)O[C@@H](C(=O)O)C
UNII:
58150F267D
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
301.075g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.273g/mol
Monoisotopic Mass:
301.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Direct and indirect photolysis of cyhalofop in aqueous systems. | Chemosphere 20110201 |
| Hydrolysis and adsorption of cyhalofop-butyl and cyhalofop-acid on soil colloids. | Journal of agricultural and food chemistry 20080709 |
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