4-[2-(3-Methylphenyl)diazenyl]benzenamine

HCID 12873CAS 722-23-6
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cccc(N=Nc2ccc(N)cc2)c1
InChIKey
KCOITMFSLVDOGO-UHFFFAOYSA-N
Molecular formula
C13H13N3
Average molar mass
211.26 g/mol
Monoisotopic mass
211.11094742

Names & identifiers

Preferred name
4-[2-(3-Methylphenyl)diazenyl]benzenamine
IUPAC
4-[(3-methylphenyl)diazenyl]aniline
English name
3'-Methylazobenzene-4-amine
Molecular formula
C13H13N3
Molecular weight
211.26

Names & synonyms

722-23-64-[2-(3-Methylphenyl)diazenyl]benzenamine4-(2-(3-Methylphenyl)diazenyl)benzenamineRefChem:2869953'-Methyl-4-aminoazobenzeneBRN 06429884-((3-Methylphenyl)azo)benzenamine4-[(3-methylphenyl)diazenyl]anilineANILINE, p-(3-METHYLPHENYLAZO)-4-amino-3'-methylazobenzeneCHEMBL84050SCHEMBL9114273
Show more names
4-m-tolylazo-anilinep-(m-Tolylazo)aniline4-(m-tolyldiazenyl)aniline3'-Methylazobenzene-4-amine
SCHEMBL9114278SCHEMBL29634208azobenzene, 4-amino-3'-methyl-KCOITMFSLVDOGO-UHFFFAOYSA-NDTXSID001269996

Database identifiers

CAS
722-23-6
PubChem CID
12873
DTXSID
DTXSID001269996
ChEMBL
CHEMBL84050
Nikkaji
J33.848F

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
50.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Physicochemical properties

Boiling point
340.95 °C · 340.95°C (rough estimate)
Density
1.1536 · 1.1536 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
pka
3.141 · 3.141±0.10(predicted)

Chemistry & industry

Suppliers3 total

深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]

Related reactions

1 records
New reaction record

Linked notes

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