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2-(2-Methoxyphenyl)acetamide

HCID 80662
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
33390-80-6
Standard SMILES
COc1ccccc1CC(N)=O
InChIKey
QHOOQLXZKWMYCC-UHFFFAOYSA-N
Molecular formula
C9H11NO2
Average molar mass
165.19 g/mol
Monoisotopic mass
165.07897859

Names & identifiers

Preferred name
2-(2-Methoxyphenyl)acetamide
IUPAC
2-(2-methoxyphenyl)acetamide
English name
2-(2-Methoxyphenyl)-acetamide
Molecular formula
C9H11NO2
Molecular weight
165.19

Names & synonyms

2-(2-Methoxyphenyl)acetamide2-MethoxybenzeneacetamideEINECS 251-491-5RefChem:454107251-491-533390-80-62-(2-METHOXYPHENYL)-ACETAMIDEMFCD01196672ZINC4690618benzeneacetamide, 2-methoxy-Benzeneacetamide,2-methoxy-ZINC04690618
Show more names
2-Methoxyphenylacetamide2-Methoxyphenyl acetamide2-methyloxyphenylacetamideUNII-RDT39HU3CZ(2-methoxyphenyl)acetamide2METHOXYPHENYLACETAMIDE2METHOXYBENZENEACETAMIDEBENZENEACETAMIDE2METHOXY

Database identifiers

CAS
33390-80-6、6343-93-7
PubChem CID
80662
DTXSID
DTXSID60955007
EC Number
251-491-5
Nikkaji
J308.480I

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
52.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
159

Physicochemical properties

Boiling point
339 · 339.0±25.0 °C(Predicted)
Density
1.123 · 1.123±0.06 g/cm3(Predicted)
pka
16.21 · 16.21±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352-P305+P351+P338

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]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

2-Methoxyphenylacetonitrile

Related reactions

9 records
New reaction record
HRID 350835 reaction equation
HRID 350835As productuspto-grants-2007_02
HRID 350836 reaction equation
HRID 350836As reactantuspto-grants-2007_02
HRID 1029957 reaction equation
HRID 1029957As reactantuspto-grants-1992_04
HRID 1029958 reaction equation
HRID 1029958As reactantuspto-grants-1992_04
HRID 1196287 reaction equation
HRID 1196287As reactantuspto-grants-1992_05
HRID 1218163 reaction equation
HRID 1218163As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 2215180 reaction equation
HRID 2215180As productuspto-grants-2006_09
HRID 2215181 reaction equation
HRID 2215181As reactantuspto-grants-2006_09
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Compound notes

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