4- (2-Phenoxyethoxy) aniline

CAT: 0024-sc-314130Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-314130Size:500 mg

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CAS Number

35965-96-9

Chemical Information

4-(2-Phenoxyethoxy)aniline

CAS Number	35965-96-9
PubChem CID	4177311
IUPAC Name	4-(2-phenoxyethoxy)aniline
Molecular Formula	C14H15NO2
Molecular Weight	229.27
XLogP	3.1
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	17
Formal Charge	0
Complexity	196

SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)N

InChI

InChI=1S/C14H15NO2/c15-12-6-8-14(9-7-12)17-11-10-16-13-4-2-1-3-5-13/h1-9H,10-11,15H2

InChIKey

AEUZGHQIEXOKBD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 35965-96-9

CID: 4177311

Formula: C14H15NO2

MW: 229.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	229.27
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	229.110278721
Monoisotopic Mass	229.110278721
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	196
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-304857	2- (2-Phenoxyethoxy) -N- (4-propoxybenzyl) aniline
sc-314129	4- (2-Phenoxyethoxy) -N- (2-propoxybenzyl) aniline
sc-344740	3-[ (2-phenoxyethoxy) methyl]aniline
sc-316436	4-Fluoro-N-[4- (2-phenoxyethoxy) benzyl]aniline
sc-316575	4-Isobutoxy-N-[4- (2-phenoxyethoxy) benzyl]aniline
sc-314944	4- (Hexyloxy) -N-[4- (2-phenoxyethoxy) benzyl]aniline
sc-344740A	3-[ (2-phenoxyethoxy) methyl]aniline
sc-307705	2-Chloro-N-[4- (2-phenoxyethoxy) benzyl]aniline
sc-316309	4-Ethoxy-N-[2- (2-phenoxyethoxy) benzyl]aniline
sc-308009	2-Fluoro-N-[4- (2-phenoxyethoxy) benzyl]aniline