Cas no 946665-04-9 (5-Bromo-2-(3-fluorophenoxy)aniline)
946665-04-9 structure
Product Name:5-Bromo-2-(3-fluorophenoxy)aniline
CAS No:946665-04-9
MF:C12H9BrFNO
MW:282.108365774155
CID:4721120
Update Time:2023-08-16
5-Bromo-2-(3-fluorophenoxy)aniline Chemical and Physical Properties
Names and Identifiers
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- 5-BROMO-2-(3-FLUOROPHENOXY)ANILINE
- 5-Bromo-2-(3-fluorophenoxy)aniline
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- Inchi： 1S/C12H9BrFNO/c13-8-4-5-12(11(15)6-8)16-10-3-1-2-9(14)7-10/h1-7H,15H2
- InChI Key： QJSGSCKBGHQRGJ-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)N)OC1C=CC=C(C=1)F
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 229
- XLogP3: 3.6
- Topological Polar Surface Area: 35.2
5-Bromo-2-(3-fluorophenoxy)aniline Related Literature
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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