Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate

CAS
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Purity
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CAS
94088-52-5
Size
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Purity
96%
Price
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Availability
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Catalog Number

ACM94088525

Product Name

Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate

Structure

Structure

CAS

94088-52-5

Category

Heterocyclic Organic Compound

Synonyms

EINECS 302-053-8, CID6433023, Sodium 2-(((2-oleoylethyl)amino)carbonyl)benzoate, 94088-52-5

IUPAC Name

sodium 2-[[(Z)-3-oxoicos-11-enyl]carbamoyl]benzoate

Molecular Weight

479.627150 [g/mol]

Molecular Formula

C₂₈H₄₃NO₅Na

Canonical SMILES

CCCCCCCCC=CCCCCCCCC(=O)CCNC(=O)C1=CC=CC=C1C(=O)[O-].[Na+]

InChI Key

DIXVAIQSJHDFAV-KVVVOXFISA-M

Boiling Point

647.5ºC at 760mmHg

Flash Point

345.4ºC

EC Number

302-053-8

Exact Mass

479.30100

H-Bond Acceptor

4

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The molecular formula is C28H42NNaO4.

What is the molecular weight of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The molecular weight is 479.6 g/mol.

When was Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate created?

It was created on February 5, 2008.

What is the IUPAC name of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The IUPAC name is sodium;2-[[(Z)-3-oxoicos-11-enyl]carbamoyl]benzoate.

What is the InChI key of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The InChI key is DIXVAIQSJHDFAV-KVVVOXFISA-M.

What is the CAS number of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The CAS number is 94088-52-5.

How many hydrogen bond donor counts does Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate have?

It has 1 hydrogen bond donor count.

What is the exact mass of Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate?

The exact mass is 479.30115310 g/mol.

How many rotatable bond counts does Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate have?

It has 20 rotatable bond counts.

Is Sodium 2-[[(2-oleoylethyl)amino]carbonyl]benzoate a canonicalized compound?

Yes, it is a canonicalized compound.

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