m-[4-(2-Cyanoethyl)-4,5-dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid

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CAS
94944-74-8
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Purity
96%
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Catalog Number

ACM94944748

Product Name

m-[4-(2-Cyanoethyl)-4,5-dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid

Structure

CAS

94944-74-8

Category

Heterocyclic Organic Compound

Synonyms

EINECS 305-652-2, CID3024409, 94944-74-8, m-(4-(2-Cyanoethyl)-4,5-dihydro-5-oxo-3-(4-((1-oxohexadecyl)amino)phenyl)-1H-pyrazol-1-yl)benzenesulphonic acid

IUPAC Name

3-[4-(2-cyanoethyl)-3-[4-(hexadecanoylamino)phenyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid

Molecular Weight

622.817840 [g/mol]

Molecular Formula

C₃₄H₄₆N₄O₅S

Canonical SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)C2=NN(C(=O)C2CCC#N)C3=CC(=CC=C3)S(=O)(=O)O

InChI Key

ADSVMOOPQPIGEI-UHFFFAOYSA-N

Density

1.19g/cm³

EC Number

305-652-2

Exact Mass

622.31900

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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