Structure

2-(2-Methoxyethoxy)aniline

CAS
72806-66-7
Catalog Number
ACM72806667
Category
Ethers
Molecular Weight
167.21
Molecular Formula
C9H13NO

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Specification

Synonyms
Ambnee4003843, 2-(2-Methoxyethoxy)aniline, MolPort-002-028-202, 2-(2-Methoxy-ethoxy)-phenylamine, EINECS 276-852-4, ZINC06678511, BAS 14599245, CID3018371, 72806-66-7
IUPAC Name
2-(2-methoxyethoxy)aniline
SMILES
COCCOC1=CC=CC=C1N
InChI Key
GGVZNGYEHJHVMK-UHFFFAOYSA-N
Boiling Point
281.6ºC at 760 mmHg
Flash Point
134.8ºC
Density
1.078g/cm³
EC Number
276-852-4
Exact Mass
167.09500
Hazard Statements
H302-H314
H-Bond Acceptor
3
H-Bond Donor
1
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 2-(2-Methoxyethoxy)aniline?

The molecular formula is C9H13NO2.

When was the compound 2-(2-Methoxyethoxy)aniline created and last modified?

It was created on August 8, 2005, and last modified on November 25, 2023.

What is the molecular weight of 2-(2-Methoxyethoxy)aniline?

The molecular weight is 167.20 g/mol.

What is the IUPAC name of 2-(2-Methoxyethoxy)aniline?

The IUPAC name is 2-(2-methoxyethoxy)aniline.

What is the Canonical SMILES notation for 2-(2-Methoxyethoxy)aniline?

The Canonical SMILES is COCCOC1=CC=CC=C1N.

What is the InChIKey for 2-(2-Methoxyethoxy)aniline?

The InChIKey is GGVZNGYEHJHVMK-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 2-(2-Methoxyethoxy)aniline have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-(2-Methoxyethoxy)aniline have?

It has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-(2-Methoxyethoxy)aniline?

The topological polar surface area is 44.5Ų.

Is the compound 2-(2-Methoxyethoxy)aniline canonicalized?

Yes, the compound is canonicalized.

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