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Structure

2-[[4-(Dimethylamino)phenyl]azo]-1,3-dimethyl-1H-imidazolium acetate

CAS
93981-01-2
Catalog Number
ACM93981012
Category
Other Products
Molecular Weight
303.359540 [g/mol]
Molecular Formula
C15H21N5O2

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Specification

Synonyms
EINECS 301-082-3, 2-((4-(Dimethylamino)phenyl)azo)-1,3-dimethyl-1H-imidazolium acetate, 93981-01-2
IUPAC Name
4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline acetate
InChI Key
DXCRCNHQYDTKNV-UHFFFAOYSA-M
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of the compound mentioned in the reference?

The molecular formula is C15H21N5O2.

What are the synonyms for the compound in the reference?

Some synonyms include 2-[[4-(Dimethylamino)phenyl]azo]-1,3-dimethyl-1H-imidazolium acetate and DTXSID00916778.

When was the compound created and last modified according to the reference?

The compound was created on July 11, 2007, and last modified on December 30, 2023.

What is the molecular weight of the compound?

The molecular weight is 303.36 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;acetate.

What is the Canonical SMILES representation of the compound?

The Canonical SMILES representation is CC(=O)[O-].CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N(C)C)C.

What is the CAS number for the compound?

The CAS number is 93981-01-2.

How many hydrogen bond acceptors does the compound have?

It has 5 hydrogen bond acceptors.

What is the topological polar surface area of the compound?

The topological polar surface area is 76.9 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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