DISPERSE RED 13

• CAS: 3180-81-2
• Catalog Number: ACM3180812
• Category: Disperse Dyes
• Molecular Weight: 348.78g/mol
• Molecular Formula: C16H17ClN4O3
• Synonyms: CI 11115;CELLITON RUBINE B;DISPERSE RED 13;ACETAMINE RUBINE B;2-[4-(2-CHLORO-4-NITROPHENYLAZO)-N-ETHYLPHENYLAMINO]ETHANOL;SETACYL RED 2B;2-((4-((2-chloro-4-nitrophenyl)azo)phenyl)ethylamino-ethano;2-[[4-[(2-chloro-4-nitrophenyl)azo]phenyl]ethylamino]-etha
• IUPAC Name: 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethanol
• Canonical SMILES: CCN(CCO)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl
• InChI: InChI=1S/C16H17ClN4O3/c1-2-20(9-10-22)13-5-3-12(4-6-13)18-19-16-8-7-14(21(23)24)11-15(16)17/h3-8,11,22H,2,9-10H2,1H3
• InChI Key: FEJPWLNPOFOBSP-UHFFFAOYSA-N
• Melting Point: 133.0 °C
• Complexity: 424
• Covalently-Bonded Unit Count: 1
• EC Number: 221-668-1
• Exact Mass: 348.098918g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 1
• Heavy Atom Count: 24
• Monoisotopic Mass: 348.098918g/mol
• Rotatable Bond Count: 6
• UNII: 8GO3E3725A
• XLogP3: 4

Custom Q&A

What is the molecular formula of Disperse Red 13?

The molecular formula of Disperse Red 13 is C16H17ClN4O3.

What is the molecular weight of Disperse Red 13?

The molecular weight of Disperse Red 13 is 348.78 g/mol.

What are some synonyms for Disperse Red 13?

Some synonyms for Disperse Red 13 include Celliton Fast Rubine B and Cibacet Rubine BS.

When was Disperse Red 13 created and last modified?

Disperse Red 13 was created on 2005-03-27 and last modified on 2023-12-23.

What is the IUPAC Name of Disperse Red 13?

The IUPAC Name of Disperse Red 13 is 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethanol.

What is the InChIKey of Disperse Red 13?

The InChIKey of Disperse Red 13 is FEJPWLNPOFOBSP-UHFFFAOYSA-N.

What is the Canonical SMILES of Disperse Red 13?

The Canonical SMILES of Disperse Red 13 is CCN(CCO)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.

What is the CAS number for Disperse Red 13?

The CAS number for Disperse Red 13 is 3180-81-2.

What is the XLogP3-AA value for Disperse Red 13?

The XLogP3-AA value for Disperse Red 13 is 4.

How many hydrogen bond acceptors does Disperse Red 13 have?

Disperse Red 13 has 6 hydrogen bond acceptors.