4,4'-Dipropoxyazoxybenzene

CAT: 0127-OR1077581Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1077581Size:5 g

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CAS Number

23315-55-1

MDL Number

MFCD00059870

Purity

>98.0%

Smiles

CCCOC1=CC=C (C=C1) N=[N+] (C2=CC=C (C=C2) OCCC) [O-]

Chemical Information

Diazene, 1,2-bis(4-propoxyphenyl)-, 1-oxide

CAS Number	23315-55-1
PubChem CID	90063
IUPAC Name	oxido-(4-propoxyphenyl)-(4-propoxyphenyl)iminoazanium
Molecular Formula	C18H22N2O3
Molecular Weight	314.4
XLogP	4.9
Topological Polar Surface Area	59.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	23
Formal Charge	0
Complexity	346

SMILES

CCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCC)[O-]

InChI

InChI=1S/C18H22N2O3/c1-3-13-22-17-9-5-15(6-10-17)19-20(21)16-7-11-18(12-8-16)23-14-4-2/h5-12H,3-4,13-14H2,1-2H3

InChIKey

YRZFKJUPVCUDMX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 23315-55-1

CID: 90063

Formula: C18H22N2O3

MW: 314.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	314.4
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	314.16304257
Monoisotopic Mass	314.16304257
Topological Polar Surface Area	59.6 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	346
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
PC5215	4,4,4,4',4',4'-Hexafluorovaline hydrochloride
PC6412	4,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
OR1011238-01	4,4,4,4-Silanetetrayltetrabenzaldehyde
OR1011275-01	4,4',4'',4'''-Methanetetrayltetraphenol
PC4810-01	4,4,4,4',4',4'-Hexafluoro-DL-valine
PC450233-01	4,4,4,4',4',4'-Hexafluorovaline, ethyl ester
OR1001790-01	4,4',4'',4'''-Silanetetrayltetrabenzoic acid
OR1011274-01	4,4',4'',4'''-Methanetetrayltetrabenzoic Acid
IN11625	(4,4′,4′′,4′′′-Tetraaminophthalocyaninato) cobalt

Catalog	Name
sc-486340	4,4'-Dipropoxyazoxybenzene
HY-W099255-01	Ethyl 4,4,4,4',4',4'-hexafluoro-DL-valinate
25725310-01	4,4'-Sulfonyldiphenol (4,4'-Dihydroxydiphenylsulfone)
JXB85075-01	4,4,4-Trifluorobutanethioamide
433631-01	4,4',4''-Methanetriyltrianiline
sc-262190	4,4,4-Trifluorobutyraldehyde
sc-476168	4,4',4''-Trihydroxytriphenylmethane
sc-262193	4,4,4-Trifluorocrotononitrile
sc-284451A	4,4,4-Trifluorobutylamine
FT77427	4,4,4-Trifluorovaline