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Structure

Ammonium N-(2-carboxyethyl)-N-dodecyl-beta-alaninate

CAS
94023-57-1
Catalog Number
ACM94023571
Category
Other Products
Molecular Weight
346.505320 [g/mol]
Molecular Formula
C18H38N2O4

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Specification

Synonyms
Ammonium N-(2-carboxyethyl)-N-dodecyl-beta-alaninate, 94023-57-1, CTK5H4677, AG-H-86327
IUPAC Name
azanium;3-[2-carboxyethyl(dodecyl)amino]propanoate
InChI Key
IHPQJWNGWKLWDT-UHFFFAOYSA-N
H-Bond Acceptor
5
H-Bond Donor
2
What is the IUPAC name of the compound?

The IUPAC name of the compound is diazanium;3-[2-carboxylatoethyl(dodecyl)amino]propanoate.

What is the molecular formula of the compound?

The molecular formula of the compound is C18H41N3O4.

When was the compound created and last modified?

The compound was created on 2009-08-20 and last modified on 2023-12-30.

What is the molecular weight of the compound?

The molecular weight of the compound is 363.5 g/mol.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the hydrogen bond acceptor count of the compound?

The compound has 5 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass of the compound is 363.30970680 g/mol.

How many rotatable bond counts does the compound have?

The compound has 15 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 85.5 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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