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2,3-Bis-(sulfooxy)propyl oleate

Name: 2,3-Bis-(sulfooxy)propyl oleate
SKU: ACM94970420-1
Rating: 5 (1 reviews)

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Catalog NumberACM94970420-1

CAS Number94970-42-0

CategoryFatty-acid Products

Synonyms

EINECS 305-696-2, 2,3-Bis(sulphooxy)propyl oleate, CID6433044, 94970-42-0

IUPAC Name

2,3-disulfooxypropyl (Z)-octadec-9-enoate

Molecular Weight

516.666300 [g/mol]

Molecular Formula

C₂₁H₄₀O₁₀S₂

InChI Key

NPRMOGCTZRQUFS-KTKRTIGZSA-N

Purity

96%

Density

1.223g/cm³

Exact Mass

516.20600

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Custom Q&A

What is the molecular formula of 2,3-Bis-(sulfooxy)propyl oleate?

The molecular formula is C21H40O10S2.

What is the molecular weight of 2,3-Bis-(sulfooxy)propyl oleate?

The molecular weight is 516.7 g/mol.

What is the IUPAC Name of 2,3-Bis-(sulfooxy)propyl oleate?

The IUPAC Name is 2,3-disulfooxypropyl (Z)-octadec-9-enoate.

What is the InChI of 2,3-Bis-(sulfooxy)propyl oleate?

The InChI is InChI=1S/C21H40O10S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(22)29-18-20(31-33(26,27)28)19-30-32(23,24)25/h9-10,20H,2-8,11-19H2,1H3,(H,23,24,25)(H,26,27,28)/b10-9-.

What is the InChIKey of 2,3-Bis-(sulfooxy)propyl oleate?

The InChIKey is NPRMOGCTZRQUFS-KTKRTIGZSA-N.

What is the Canonical SMILES of 2,3-Bis-(sulfooxy)propyl oleate?

The Canonical SMILES is CCCCCCCCC=CCCCCCCCC(=O)OCC(COS(=O)(=O)O)OS(=O)(=O)O.

What is the Isomeric SMILES of 2,3-Bis-(sulfooxy)propyl oleate?

The Isomeric SMILES is CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COS(=O)(=O)O)OS(=O)(=O)O.

What is the CAS number of 2,3-Bis-(sulfooxy)propyl oleate?

The CAS number is 94970-42-0.

What is the European Community (EC) Number of 2,3-Bis-(sulfooxy)propyl oleate?

The European Community (EC) Number is 305-696-2.

What is the XLogP3-AA value of 2,3-Bis-(sulfooxy)propyl oleate?

The XLogP3-AA value is 5.5.

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