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N-(2,6-dimethylphenyl)-2-(3-methylphenoxy)acetamide

HCID 743471
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Basic information

CAS
331859-42-8
Standard SMILES
Cc1cccc(OCC(=O)Nc2c(C)cccc2C)c1
InChIKey
HKDKBVXTKDIDPJ-UHFFFAOYSA-N
Molecular formula
C17H19NO2
Average molar mass
269.34 g/mol
Monoisotopic mass
269.14157885

Names & identifiers

Preferred name
N-(2,6-dimethylphenyl)-2-(3-methylphenoxy)acetamide
IUPAC
N-(2,6-dimethylphenyl)-2-(3-methylphenoxy)acetamide

Names & synonyms

N-(2,6-dimethylphenyl)-2-(3-methylphenoxy)acetamideCBChromo1_000338Cambridge id 5373563Oprea1_089193Oprea1_761768AKOS000558661AB00083317-01AG-690/11550084Z19732993331859-42-8

Database identifiers

CAS
331859-42-8
PubChem CID
743471
EC Number
150-051-9

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
308

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

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Compound notes

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