Catalog No.:AA0035MY

939-90-2 | Trans-2-phenyl-1-cyclopropanecarboxylic acid

Name: Name:Trans-2-phenyl-1-cyclopropanecarboxylic acid
Brand: AABLOCKS
SKU: AA0035MY
Availability: InStock
Rating: 90 (10 reviews)

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25g

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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature
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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA0035MY

Chemical Name:

Trans-2-phenyl-1-cyclopropanecarboxylic acid

CAS Number:

939-90-2

Molecular Formula:

C10H10O2

Molecular Weight:

162.1852

MDL Number:

MFCD00001292

SMILES:

OC(=O)[C@@H]1C[C@H]1c1ccccc1

NSC Number:

40846

Properties

BP:

317.1°C at 760 mmHg

Form:

Solid

MP:

86-88 °C(lit.)

Refractive Index:

1.5782 (estimate)

Storage:

Keep in dry area;Room Temperature;

Computed Properties

Complexity:

182

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

1.6

Upstream Synthesis Route

124-38-9

36617-02-4

939-89-9

939-90-2

[1]Synthesis(Germany),2016,vol.48,#17,p.2816-2822

946-38-3

939-89-9

939-90-2

[1]JournalfuerPraktischeChemie(Leipzig),1982,vol.324,#3,p.491-497

201230-82-2

3234-51-3

939-89-9

939-90-2

[1]JournalofMedicinalChemistry,2011,vol.54,#4,p.957-969

939-90-2

1986-47-6

[1]JournalofMedicinalChemistry,1996,vol.39,#7,p.1485-1493

[2]BioorganicandMedicinalChemistry,2009,vol.17,#6,p.2388-2399

[3]AngewandteChemie-InternationalEdition,2018,vol.57,#30,p.9501-9504

[4]Angew.Chem.,2018,vol.130,#30,p.9645-9648,4

Downstream Synthesis Route

939-89-9

939-90-2

939-87-7

[1]JournaloftheAmericanChemicalSociety,1948,vol.70,p.2198,2201

939-90-2

trans2-(2-nitrophenyl)cyclopropylcarboxylicacid

trans-2-(p-Nitrophenyl-)cyclopropanecarboxylicacid

[1]Markees;Burger[JournaloftheAmericanChemicalSociety,1948,vol.70,p.3329,3332]Markees;Burger[JournaloftheAmericanChemicalSociety,1948,vol.70,p.2031,2032]

[2]CurrentPatentAssignee:SANOFI-US2012/277220,2012,A1Locationinpatent:Page/Pagecolumn22

64-17-5

939-90-2

946-39-4

[1]Sychkova,L.D.;Kharitonova,O.V.;Shabarov,Yu.S.[JournalofOrganicChemistryUSSR(EnglishTranslation),1983,vol.19,p.1298-1301][ZhurnalOrganicheskoiKhimii,1983,vol.19,#7,p.1445-1448]

[2]Wiśniewska,Catalina;Koszelewski,Dominik;Zysk,Małgorzata;Ostaszewski,Ryszard[BiocatalysisandBiotransformation,2015,vol.33,#2,p.98-104]

946-38-3

939-89-9

939-90-2

[1]JournalfurpraktischeChemie(Leipzig1954),1982,vol.324,p.491-497

946-39-4

939-90-2

[1]Binda,Claudia;Valente,Sergio;Romanenghi,Mauro;Pilotto,Simona;Cirilli,Roberto;Karytinos,Aristotele;Ciossani,Giuseppe;Botrugno,OronzaA.;Forneris,Federico;Tardugno,Maria;Edmondson,DaleE.;Minucci,Saverio;Mattevi,Andrea;Mai,Antonello[JournaloftheAmericanChemicalSociety,2010,vol.132,#19,p.6827-6833]

[2]Wiśniewska,Catalina;Koszelewski,Dominik;Zysk,Małgorzata;Ostaszewski,Ryszard[BiocatalysisandBiotransformation,2015,vol.33,#2,p.98-104]

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1Locationinpatent:Page/Pagecolumn90

[4]Locationinpatent:experimentalpartSung,JinCho;Jensen,NielsH.;Kurome,Toru;Kadari,Sudhakar;Manzano,MichaelL.;Malberg,JessicaE.;Caldarone,Barbara;Roth,BryanL.;Kozikowski,AlanP.[JournalofMedicinalChemistry,2009,vol.52,#7,p.1885-1902]

[5]Sorba,J.;Fossey,J.;Nedelec,J,Y.;Lefort,D.[Tetrahedron,1982,vol.38,#14,p.2083-2088]

[6]Aggarwal,VarinderK.;DeVicente,Javier;Bonnert,RogerV.[OrganicLetters,2001,vol.3,#17,p.2785-2788]

[7]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM);CASEWESTERNRESERVEUNIVERSITY-WO2007/25144,2007,A1Locationinpatent:Page/Pagecolumn35;72

[8]Vianello,Paola;Botrugno,OronzaA.;Cappa,Anna;DalZuffo,Roberto;Dessanti,Paola;Mai,Antonello;Marrocco,Biagina;Mattevi,Andrea;Meroni,Giuseppe;Minucci,Saverio;Stazi,Giulia;Thaler,Florian;Trifiró,Paolo;Valente,Sergio;Villa,Manuela;Varasi,Mario;Mercurio,Ciro[JournalofMedicinalChemistry,2016,vol.59,#4,p.1501-1517]

[9]Horáková,Eva;Drabina,Pavel;Brož,Břetislav;Štěpánková,Šárka;Vorčáková,Katarína;Královec,Karel;Havelek,Radim;Sedlák,Miloš[JournalofEnzymeInhibitionandMedicinalChemistry,2016,vol.31,p.173-179]

[10]Zhou,Chao;Wu,Fangrui;Lu,Lianghao;Wei,Liping;Pai,Eric;Yao,Yuan;Song,Yongcheng[PLoSONE,2017,vol.12,#2]

[11]Horáková,Eva;Drabina,Pavel;Brůčková,Lenka;Štěpánková,Šárka;Vorčáková,Katarína;Sedlák,Miloš[MonatsheftefurChemie,2017,vol.148,#12,p.2143-2153]

Literature

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