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2-Ethylaniline

CAT: 1596-AR-E02326-01Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-E02326-01Size:50 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
578-54-1
Synonyms
O-Ethylaniline; 2-Ethylbenzenamine; o-Aminoethylbenzene; 2-Ethylphenylamine;2-ethylaniline;2-ethylbenzenamine; (9z) -n- (2-hydroxyethyl) -9-octadecenamide; akos 91138; akos bbs-00003570; labotest-bb ltbb000732; n- (2-hydroxyethyl) -9z-octadecenamide; n- (2-hydroxyethyl) oleamide; n-[cis-9-octadecenoyl]ethanolamine; noe; n-oleoylethanolamide; n-oleoyl ethanolamine; o-aminoethylbenzene; oea; o-ethylaniline; oleic acid ethanolamide; oleic monoethanolamide; oleoyl ethanolamide; oleylethanolamide; orthoethylaniline
Molecular Formula
C8H11N
Molecular Weight
121.18
API Name
Reagent

Chemical Information

2-Ethylaniline

2-ethylaniline appears as a brown liquid. Insoluble in water and less dense than water. Hence floats on water. May irritate skin, eyes and mucous membranes. Toxic by ingestion, inhalation or skin absorption.

CAS Number578-54-1
PubChem CID11357
IUPAC Name2-ethylaniline
Molecular FormulaC8H11N
Molecular Weight121.18
XLogP1.7
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity80
SMILES
CCC1=CC=CC=C1N
InChI
InChI=1S/C8H11N/c1-2-7-5-3-4-6-8(7)9/h3-6H,2,9H2,1H3
InChIKey
MLPVBIWIRCKMJV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Ethylaniline
CAS: 578-54-1
CID: 11357
Formula: C8H11N
MW: 121.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight121.18
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass121.089149355
Monoisotopic Mass121.089149355
Topological Polar Surface Area26 Ų
Heavy Atom Count9
Formal Charge0
Complexity80.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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