Catalog No.:AA005KGW

81465-88-5 | 2-Hydroxy-4-(trifluoromethyl)benzonitrile

Name: Name:2-Hydroxy-4-(trifluoromethyl)benzonitrile
Brand: AABLOCKS
SKU: AA005KGW
Availability: InStock
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250mg

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

Technical Information

Catalog Number:

AA005KGW

Chemical Name:

2-Hydroxy-4-(trifluoromethyl)benzonitrile

CAS Number:

81465-88-5

Molecular Formula:

C8H4F3NO

Molecular Weight:

187.1187

MDL Number:

MFCD13186735

SMILES:

N#Cc1ccc(cc1O)C(F)(F)F

Properties

BP:

266.1°C at 760 mmHg

Storage:

Inert atmosphere;2-8℃;

Computed Properties

Complexity:

229

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

XLogP3:

2.7

Downstream Synthesis Route

81465-87-4

81465-88-5

[1]CurrentPatentAssignee:ELILILLY&CO-US4322429,1982,A

[2]CurrentPatentAssignee:ELILILLY&CO-US4336264,1982,A

6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)benzonitrile

81465-88-5

[1]Locationinpatent:experimentalpartKallepalli,VenkataA.;Sanchez,Luis;Li,Hao;Gesmundo,NathanJ.;Turton,ClarissaL.;MaleczkaJr.,RobertE.;SmithIII,MiltonR.[Heterocycles,2010,vol.80,#2,p.1429-1448]

81465-88-5

358-23-6

1224867-15-5

[1]Locationinpatent:experimentalpartKallepalli,VenkataA.;Sanchez,Luis;Li,Hao;Gesmundo,NathanJ.;Turton,ClarissaL.;MaleczkaJr.,RobertE.;SmithIII,MiltonR.[Heterocycles,2010,vol.80,#2,p.1429-1448]

Literature

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SDS