2- (2-Methoxyethoxy) aniline

CAT: 0127-OR962692-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR962692-01Size:100 mg

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CAS Number

72806-66-7

MDL Number

MFCD08144123

Purity

97%

Smiles

COCCOc1ccccc1N

Chemical Information

2-(2-Methoxyethoxy)aniline

CAS Number	72806-66-7
PubChem CID	3018371
IUPAC Name	2-(2-methoxyethoxy)aniline
Molecular Formula	C9H13NO2
Molecular Weight	167.20
XLogP	1
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	119

SMILES

COCCOC1=CC=CC=C1N

InChI

InChI=1S/C9H13NO2/c1-11-6-7-12-9-5-3-2-4-8(9)10/h2-5H,6-7,10H2,1H3

InChIKey

GGVZNGYEHJHVMK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 72806-66-7

CID: 3018371

Formula: C9H13NO2

MW: 167.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	167.20
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	167.094628657
Monoisotopic Mass	167.094628657
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	119
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
OR913383-01	4- (2-Methoxyethoxy) aniline
OR959268-01	3- (2-Methoxyethoxy) aniline
PC102005-01	2- (2-Methoxyethoxy) -5- (trifluoromethyl) aniline
OR32759-01	2,4-Dichloro-5- (2-methoxyethoxy) aniline
PC403180	3,5-Difluoro-4- (2-methoxyethoxy) aniline
OR84987-01	2- (Methoxymethoxy) aniline
OR1009698-01	2- (2-Methoxyethoxy) benzenesulfonamide
OR1009700-01	2- (2-Methoxyethoxy) Ethylmethacrylate
OR1009699-01	2- (2-Methoxyethoxy) Ethanethiol
OR962770-01	2- (2-Methoxyethoxy) -benzonitrile

Catalog	Name
sc-344185	3- (2-methoxyethoxy) aniline
428659-01	4- (2-Methoxyethoxy) aniline
sc-344729A	3-[ (2-methoxyethoxy) methyl]aniline
sc-289437	4- (2-methoxyethoxy) aniline hydrochloride
RQB70642-01	4-[ (2-Methoxyethoxy) methyl]aniline
sc-288659	3- (2-methoxyethoxy) aniline hydrochloride
BFA41502-01	3- (2- (2-Methoxyethoxy) ethoxy) aniline
EWB23568-01	5-Methanesulfonyl-2- (2-methoxyethoxy) aniline
WMB78432-01	4- (2-Methoxyethoxy) -2- (trifluoromethyl) aniline
WMB68370-01	5-fluoro-2- (2-methoxyethoxy) aniline