Solvent Red 3

CAT: 1299-RG-P022585-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-P022585-04Size:100 mg

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CAS Number

6535-42-8

Synonyms

4- ((4-ethoxyphenyl) diazenyl) naphthalen-1-ol

Molecular Formula

C18H16N2O2

Molecular Weight

292.34

Product Name Synonym

4- ((4-ethoxyphenyl) diazenyl) naphthalen-1-ol

Chemical Information

1-Naphthalenol, 4-[(4-ethoxyphenyl)azo]-

See also: Solvent Red 3 (annotation moved to).

CAS Number	6535-42-8
PubChem CID	81021
IUPAC Name	4-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol
Molecular Formula	C18H16N2O2
Molecular Weight	292.3
XLogP	4.9
Topological Polar Surface Area	54.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	366

SMILES

CCOC1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)O

InChI

InChI=1S/C18H16N2O2/c1-2-22-14-9-7-13(8-10-14)19-20-17-11-12-18(21)16-6-4-3-5-15(16)17/h3-12,21H,2H2,1H3

InChIKey

JSEYDVLGSMLKDL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6535-42-8

CID: 81021

Formula: C18H16N2O2

MW: 292.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	292.3
XLogP3	4.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	292.121177757
Monoisotopic Mass	292.121177757
Topological Polar Surface Area	54.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	366
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