chempirical

Disperse red 1

C16H18N4O3CAS 2872-52-8314.35 g/mol

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NHONNN+OO−
AlcoholAzoNitroTertiary amine

Properties

Molecular formula
C16H18N4O3
Molar mass
314.35 g/mol
Exact mass
314.1379 Da
Melting point
161 °C
logP
3.83Crippen estimate
Polar surface area
91.3 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
7

Identifiers

CAS number
2872-52-8
SMILES
CCN(CCO)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1
InChIKey
FOQABOMYTOFLPZ-UHFFFAOYSA-N
InChI
InChI=1S/C16H18N4O3/c1-2-19(11-12-21)15-7-3-13(4-8-15)17-18-14-5-9-16(10-6-14)20(22)23/h3-10,21H,2,11-12H2,1H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

68 names · show all
  • Ethanol, 2-[ethyl[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]-
  • Celliton scarlet B
  • C.I. Disperse red 1
  • Ethanol, 2-[ethyl[4-[(4-nitrophenyl)azo]phenyl]amino]-
  • 2-[Ethyl[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]ethanol
  • C.I. 11110
  • Acetamine scarlet B
  • Acetate fast scarlet B
  • Acetoquinone light scarlet BLZ
  • Amacel scarlet GB
  • Calcosyn brilliant scarlet BN
  • Celliton discharge scarlet B
  • Celliton scarlet BA-CF
  • Celutate scarlet BH
  • Cibacet scarlet BRN
  • Cibacet scarlet 2B
  • Cibacet scarlet BS
  • Cilla scarlet B
  • Diacelliton scarlet B
  • Disperse scarlet B
  • Dispersol fast scarlet B
  • Durgacet scarlet B
  • Eastone scarlet BG
  • Eniacyl scarlet B
  • N-Ethyl-N-[p-(p-nitrophenylazo)phenyl]ethanolamine
  • Fenacet scarlet B
  • Interchem acetate scarlet B
  • Interchem hisperse scarlet BH
  • Kayalon fast scarlet B
  • Microsetile scarlet B
  • Miketon fast scarlet B
  • Monocel scarlet B
  • Nacelan scarlet CSB
  • Neosetile scarlet B
  • 4-Nitro-4′-[N-ethyl-N-(β-hydroxyethyl)amino]azobenzene
  • Nyloquinone red N
  • Reliton scarlet BA
  • Safaritone scarlet B
  • Scarlet reliton BA
  • Serinyl hoisery scarlet BD
  • Serisol fast scarlet BD
  • Setacyl scarlet B
  • Setacyl scarlet 2BD
  • Setacyl scarlet RNA
  • Silotras scarlet TSR
  • Supracet fast scarlet B
  • Tertranese scarlet N-B
  • Disperse scarlet zh
  • 4-Nitro-4′-[ethyl(2-hydroxyethyl)amino]azobenzene
  • Disperse red zh
  • N-Ethyl-N-(2-hydroxyethyl)-4-[(p-nitrophenyl)azo]aniline
  • 4-[N-Ethyl-N-(2-hydroxyethyl)amino]-4′-nitroazobenzene
  • Dispersive ruby Zh
  • Dispersol scarlet B
  • C.I. Solvent red 14
  • WO 4
  • 4-[Ethyl(2-hydroxyethyl)amino]-4′-nitroazobenzene
  • Diacelliton fast scarlet B
  • Serisol fast scarlet BD 200
  • 4-[(2-Hydroxyethyl)ethylamino]-4′-nitroazobenzene
  • 1-[N-Ethyl-N-(2-hydroxyethyl)amino]-4-(4-nitrophenylazo)benzene
  • 4-[4-(Nitrophenyl)azo]-N-ethyl-N-(2-hydroxyethyl)aniline
  • Intrasperse scarlet BRN
  • NSC 57019
  • N-Ethyl-N-(2-hydroxyethyl)-4-(4-nitrophenylazo)aniline
  • 4-[N-(2-Hydroxyethyl)-N-ethylamino]-4′-nitroazobenzene
  • Fluka disperse red
  • D 3284

Work with Disperse red 1

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Disperse orange 2531482-56-171 % similar N,N-Diethyl-4-nitrobenzenamine2216-15-163 % similar 2-[[4-[2-(2-Chloro-4-nitrophenyl)diazenyl]phenyl]ethylamino]-N,N,N-trimethylethanaminium14097-03-157 % similar 2-[2-[4-[(2-Cyanoethyl)ethylamino]phenyl]diazenyl]-5-nitrobenzonitrile16889-10-455 % similar 3-[[4-[2-(2,6-Dibromo-4-nitrophenyl)diazenyl]phenyl]ethylamino]propanenitrile12270-45-054 % similar Hc blue 12132885-85-950 % similar 4-[4-(4-Nitrophenyl)-1-piperazinyl]phenol112559-81-649 % similar 1-(4-Nitrophenyl)piperidine6574-15-849 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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