Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate

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CAS
93982-27-5
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Purity
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Catalog Number

ACM93982275

Product Name

Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate

CAS

93982-27-5

What is the molecular formula of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The molecular formula is C24H43NNa2O4.

What is the molecular weight of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The molecular weight is 455.6 g/mol.

What is the IUPAC name of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The IUPAC name is disodium;3-[2-carboxylatoethyl-[(E)-octadec-9-enyl]amino]propanoate.

What is the InChI of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The InChI is InChI=1S/C24H45NO4.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25(21-18-23(26)27)22-19-24(28)29;;/h9-10H,2-8,11-22H2,1H3,(H,26,27)(H,28,29);;/q;2*+1/p-2/b10-9+;;.

What is the canonical SMILES of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The canonical SMILES is CCCCCCCCC=CCCCCCCCCN(CCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+].

What is the CAS number of Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate?

The CAS number is 93982-27-5.

How many hydrogen bond donor counts does Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate have?

It has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does Disodium N-(2-carboxylatoethyl)-N-9-octadecenyl-beta-alaninate have?

It has 20 rotatable bond counts.

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