Disperse Orange 44

• CAS: 12223-26-6
• Catalog Number: ACM12223266
• Category: Disperse Dyes
• Molecular Weight: 382.8
• Molecular Formula: C₁₈H₁₅ClN₆O₂
• Synonyms: 4-((2-chloro-4-nitrophenyl)azo)-n,n-biscyanoethylaniline;Disperse Orange S2;3,3'-((4-((2-Chloro-4-nitrophenyl)azo)phenyl)imino)bis(propiononitrile);Disperse Orange 44;Orange S-3RFL
• IUPAC Name: 3-[4-(2-chloro-4-nitrophenyl)diazenyl-N-(2-cyanoethyl)anilino]propanenitrile
• Canonical SMILES: C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N(CCC#N)CCC#N
• InChI Key: ZXXVVTBKBDDTSE-UHFFFAOYSA-N
• Boiling Point: 663.8ºC at 760 mmHg
• Flash Point: 355.3ºC
• Density: 1.3g/cm³
• EC Number: 223-765-4
• Exact Mass: 354.06300
• H-Bond Acceptor: 7
• H-Bond Donor: 0

Custom Q&A

What is the PubChem CID for Disperse Orange 44?

The PubChem CID for Disperse Orange 44 is 77677.

What is the molecular formula of Disperse Orange 44?

The molecular formula of Disperse Orange 44 is C18H15ClN6O2.

What are the synonyms for Disperse Orange 44?

The synonyms for Disperse Orange 44 include 4058-30-4, 12223-26-6, and Propanenitrile, 3,3'-[[4-[(2-chloro-4-nitrophenyl)azo]phenyl]imino]bis- 3-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(2-cyanoethyl)anilino]propanenitrile.

What is the molecular weight of Disperse Orange 44?

The molecular weight of Disperse Orange 44 is 382.8 g/mol.

When was Disperse Orange 44 created and modified?

Disperse Orange 44 was created on August 8, 2005, and modified on December 23, 2023.

What is the IUPAC name of Disperse Orange 44?

The IUPAC name of Disperse Orange 44 is 3-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(2-cyanoethyl)anilino]propanenitrile.

What is the InChIKey of Disperse Orange 44?

The InChIKey of Disperse Orange 44 is ZXXVVTBKBDDTSE-UHFFFAOYSA-N.

What is the Canonical SMILES of Disperse Orange 44?

The Canonical SMILES of Disperse Orange 44 is C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N(CCC#N)CCC#N.

What is the CAS number of Disperse Orange 44?

The CAS number of Disperse Orange 44 is 4058-30-4.

What is the XLogP3-AA value of Disperse Orange 44?

The XLogP3-AA value of Disperse Orange 44 is 3.7.

What is the InChI of Disperse Orange 44?

The InChI of Disperse Orange 44 is InChI=1S/C18H15ClN6O2/c19-17-13-16(25(26)27)7-8-18(17)23-22-14-3-5-15(6-4-14)24(11-1-9-20)12-2-10-21/h3-8,13H,1-2,11-12H2.

How many hydrogen bond donor counts does Disperse Orange 44 have?

Disperse Orange 44 has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Disperse Orange 44 have?

Disperse Orange 44 has 7 hydrogen bond acceptor counts.