Catalog No.:AA0014OD

13338-63-1 | 3,4,5-Trimethoxyphenylacetonitrile

Name: Name:3,4,5-Trimethoxyphenylacetonitrile
Brand: AABLOCKS
SKU: AA0014OD
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97%

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10g

97%

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$56.00 $39.00

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25g

95%

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100g

95%

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA0014OD

Chemical Name:

3,4,5-Trimethoxyphenylacetonitrile

CAS Number:

13338-63-1

Molecular Formula:

C11H13NO3

Molecular Weight:

207.2258

MDL Number:

MFCD00001912

SMILES:

N#CCc1cc(OC)c(c(c1)OC)OC

NSC Number:

97556

Properties

BP:

346.25°C (rough estimate)

Form:

Solid

MP:

77-79 °C(lit.)

Refractive Index:

1.5100 (estimate)

Storage:

Keep in dry area;Room Temperature;

Computed Properties

Complexity:

221

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

XLogP3:

1.1

Literature

Title: (Z)-3-(1H-Indol-3-yl)-2-(3,4,5-tri-methoxy-phen-yl)acrylonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: (Z)-3-(1-Benzofuran-2-yl)-2-(3,4,5-tri-meth-oxy-phen-yl)acrylonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: (Z)-3-(Benzo[b]thiophen-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrile and (E)-3-(benzo[b]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile. [corrected].

Journal: Acta crystallographica. Section C, Crystal structure communications 20071201

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