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94742-93-5,MFCD09800518

Catalog No.:AA00IIFB

94742-93-5 | 2-Cyano-5-methoxy-3-methyl-benzoic acid methyl ester

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Purity

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Quantity

1g

97%

in stock

$366.00 $257.00

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Technical Information
Properties
Downstream Synthesis Route
Literature
Request for Quotation
Download SDS

Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA00IIFB

Chemical Name:

2-Cyano-5-methoxy-3-methyl-benzoic acid methyl ester

CAS Number:

94742-93-5

Molecular Formula:

C11H11NO3

Molecular Weight:

205.2099

MDL Number:

MFCD09800518

SMILES:

COc1cc(C)c(c(c1)C(=O)OC)C#N

Properties

Computed Properties

Complexity:

281

Covalently-Bonded Unit Count:

1

Heavy Atom Count:

15

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

3

XLogP3:

1.8

Downstream Synthesis Route

544-92-3

94742-92-4

94742-93-5

[1]Carvalho,ChristopherF.;Sargent,MelvynV.;Stanojevic,Edi[AustralianJournalofChemistry,1984,vol.37,#26,p.2111-2117]

94742-93-5

103203-38-9

[1]Carvalho,ChristopherF.;Sargent,MelvynV.;Stanojevic,Edi[AustralianJournalofChemistry,1984,vol.37,#26,p.2111-2117]

2615-71-6

94742-93-5

[1]Carvalho,ChristopherF.;Sargent,MelvynV.;Stanojevic,Edi[AustralianJournalofChemistry,1984,vol.37,#26,p.2111-2117]

94742-89-9

94742-93-5

[1]Carvalho,ChristopherF.;Sargent,MelvynV.;Stanojevic,Edi[AustralianJournalofChemistry,1984,vol.37,#26,p.2111-2117]

94742-93-5

94742-94-6

[1]Carvalho,ChristopherF.;Sargent,MelvynV.;Stanojevic,Edi[AustralianJournalofChemistry,1984,vol.37,#26,p.2111-2117]

Literature

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SDS

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Tags:94742-93-5 Molecular Formula|94742-93-5 MDL|94742-93-5 SMILES|94742-93-5 2-Cyano-5-methoxy-3-methyl-benzoic acid methyl ester