Catalog No.:AA006ACS

72101-53-2 | Benzoic acid,3-butoxy-4-nitro-

Name: Name:Benzoic acid,3-butoxy-4-nitro-
Brand: AABLOCKS
SKU: AA006ACS
Availability: InStock
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250mg

95%

1 week

$27.00 $19.00

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95%

1 week

$74.00 $52.00

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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:

AA006ACS

Chemical Name:

Benzoic acid,3-butoxy-4-nitro-

CAS Number:

72101-53-2

Molecular Formula:

C11H13NO5

Molecular Weight:

239.2246

MDL Number:

MFCD00024721

SMILES:

[O-][N+](=O)c1c(OCCCC)cccc1C(=O)O

NSC Number:

76562

Properties

Form:

Solid

MP:

173 - 175°C

Storage:

-20 ℃;

Computed Properties

Complexity:

276

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

Downstream Synthesis Route

72101-53-2

4-amino-3-butoxy-benzoicacid-(2-piperidino-ethylester)

[1]Buechietal.[HelveticaChimicaActa,1951,vol.34,p.1002,1008,1010]

72101-53-2

100-36-7

4-amino-3-butoxy-benzoicacid-(2-diethylamino-ethylamide)

[1]Buechietal.[HelveticaChimicaActa,1951,vol.34,p.1002,1008,1010]

72101-53-2

100-37-8

99-43-4

[1]HelveticaChimicaActa,1951,vol.34,p.1002,1008,1010

[2]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1955,vol.75,p.215,217 Chem.Abstr.,1956,p.1666

72101-53-2

4-amino-3-butoxy-benzoicacidmethylester

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2011/130398,2011,A1

Literature

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SDS