Name: Name:(4-Fluorophenylthio)propan-2-one
Brand: AABLOCKS
SKU: AA002Z0B
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA002Z0B

Chemical Name: (4-Fluorophenylthio)propan-2-one

CAS Number: 2968-13-0

Molecular Formula: C9H9FOS

Molecular Weight: 184.2306

MDL Number: MFCD00179340

SMILES: CC(=O)CSc1ccc(cc1)F

Properties

BP: 100-103°C at 1 mmHg

Storage: 2-8℃;Inert atmosphere;

Complexity: 153

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.3

Downstream Synthesis Route

2968-13-0

143-33-9

397330-27-7

[1]Becker,DanielP;DeCrescenzo,Gary;Freskos,John;Getman,DanielP;Hockerman,SusanL;Li,Madeleine;Mehta,Pramod;Munie,GraceE;Swearingen,Craig[BioorganicandMedicinalChemistryLetters,2001,vol.11,#20,p.2723-2725]

371-42-6

78-95-5

2968-13-0

[1]Masaki,Hidekazu;Mizuno,Yusuke;Tatui,Akira;Murakami,Akira;Koide,Yuuki;Satoh,Shoji;Takahashi,Atsuo[BioorganicandMedicinalChemistryLetters,2003,vol.13,#22,p.4085-4088]

[2]Chan,WeiChuen;Koide,Kazunori[OrganicLetters,2018,vol.20,#24,p.7798-7802]

[3]Carta,Antonio;Loriga,Mario;Paglietti,Giuseppe;Mattana,Antonella;Fiori,PierLuigi;Mollicotti,Paola;Sechi,Leonardo;Zanetti,Stefania[EuropeanJournalofMedicinalChemistry,2004,vol.39,#2,p.195-203]

[4]Locationinpatent:experimentalpartMésangeau,Christophe;Fraise,Mikaël;Delagrange,Philippe;Caignard,DanielHenri;Boutin,JeanAlbert;Berthelot,Pascal;Yous,Saïd[EuropeanJournalofMedicinalChemistry,2011,vol.46,#5,p.1835-1840]

[5]Becker,DanielP;DeCrescenzo,Gary;Freskos,John;Getman,DanielP;Hockerman,SusanL;Li,Madeleine;Mehta,Pramod;Munie,GraceE;Swearingen,Craig[BioorganicandMedicinalChemistryLetters,2001,vol.11,#20,p.2723-2725]

[6]Matsunaga,Nobuyuki;Kaku,Tomohiro;Itoh,Fumio;Tanaka,Toshimasa;Hara,Takahito;Miki,Hiroshi;Iwasaki,Masahiko;Aono,Tetsuya;Yamaoka,Masuo;Kusaka,Masami;Tasaka,Akihiro[Bioorganicandmedicinalchemistry,2004,vol.12,#9,p.2251-2273]

2968-13-0

17514-63-5

[1]Masaki,Hidekazu;Mizuno,Yusuke;Tatui,Akira;Murakami,Akira;Koide,Yuuki;Satoh,Shoji;Takahashi,Atsuo[BioorganicandMedicinalChemistryLetters,2003,vol.13,#22,p.4085-4088]

[2]Matsunaga,Nobuyuki;Kaku,Tomohiro;Itoh,Fumio;Tanaka,Toshimasa;Hara,Takahito;Miki,Hiroshi;Iwasaki,Masahiko;Aono,Tetsuya;Yamaoka,Masuo;Kusaka,Masami;Tasaka,Akihiro[Bioorganicandmedicinalchemistry,2004,vol.12,#9,p.2251-2273]

2968-13-0

171111-70-9

691357-04-7

[1]Carta,Antonio;Loriga,Mario;Paglietti,Giuseppe;Mattana,Antonella;Fiori,PierLuigi;Mollicotti,Paola;Sechi,Leonardo;Zanetti,Stefania[EuropeanJournalofMedicinalChemistry,2004,vol.39,#2,p.195-203]

2968-13-0

698367-36-1

[1]Matsunaga,Nobuyuki;Kaku,Tomohiro;Itoh,Fumio;Tanaka,Toshimasa;Hara,Takahito;Miki,Hiroshi;Iwasaki,Masahiko;Aono,Tetsuya;Yamaoka,Masuo;Kusaka,Masami;Tasaka,Akihiro[Bioorganicandmedicinalchemistry,2004,vol.12,#9,p.2251-2273]

2968-13-0 | (4-Fluorophenylthio)propan-2-one