CAS 60-09-3|4-aminoazobenzene|4-[(E)-2-Phenyldiazenyl]aniline|4-[(E)-2-phenyldiazen-1-yl]aniline|4-(phenylazo)aniline|4-(Phenyldiazenyl)aniline|4-(2-phenyldiazen-1-yl)aniline|p-AMINOAZOBENZENE|(E)-4...

General Information

Structure

Molecular Formula

C₁₂H₁₁N₃

Molecular Mass

197.23584

Exact Mass

197.09529737

Charge

InChI

InChI=1S/C12H11N3/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h1-9H,13H2/b15-14+

InChIKey

QPQKUYVSJWQSDY-CCEZHUSRSA-N

Canonic Smiles

Nc1ccc(cc1)/N=N/c1ccccc1

Isomeric Smiles

N(=N\c1ccccc1)/c1ccc(N)cc1

Calculated Properties

JChem

LogD (pH = 7.4)

3.55

LogD (pH = 5.5)

3.55

Log P

3.55

Rotatable Bonds

H Donor

H Acceptors

Lipinski's Rule of Five

true

Acid pKa

3.06

Polar Surface Area

50.74

Polarizability

21.91

Molar Refractivity

65.08

LOG S

-3.36

Data Source

Names and Identifiers

IUPAC Traditional name

4-aminoazobenzene 4-(phenylazo)aniline aniline yellow

Synonyms

4-[(E)-2-Phenyldiazenyl]aniline4-(Phenyldiazenyl)anilinep-AMINOAZOBENZENE(E)-4-(phenyldiazenyl)anilineANILINE YELLOW, ALCOHOL SOLUBLEp-Phenylazoaniline Sudan Yellow RAStearix Brown 4R AABSomalia Yellow 2GC.I. 11000Oil Yellow 2GSudan Yellow R4-Aminoazobenzene Organol Yellowpara-aminoazobenzene4-phenylazoanilineOil Yellow ANOil Yellow BFast spirit YellowSolvent YellowAniline Yellow4-氨基偶氮苯Oil Yellow RBrasilazina oil Yellow GOrganol Yellow 2ACeres YellowOil Yellow AAB4-苯基偶氮苯胺Induline R4-[phenyldiazenyl]anilinep-aminoazobenzeneAniline Yellow4-Phenylazophenylamine4-(Phenylazo)benzenamine4-(phenyldiazenyl)aniline4-Phenylazo-phenylaminep-AAZB4-(phenylazo)anilineAAB4-Amino-1,1'-azobenzene4-AAB4-AminoazobenzeneAniline yellow

IUPAC name

4-[(E)-2-phenyldiazen-1-yl]aniline 4-(2-phenyldiazen-1-yl)aniline 4-[(1E)-2-phenyldiazen-1-yl]aniline

Names and Identifiers

Registration numbers

CAS Number

60-09-3

PubChem SID

160985217248698422485121685427132

PubChem CID

6051

MDL Number

MFCD00007854